ORGANIC CHEMISTRY DIRECTORY

Organic Chemistry
Directory

	Launched 4/4/08, last update 05/07/12 last site check 08/17/11 Steve Murov, Professor Emeritus of Chemistry http://murov.info/ http://murov.info/resume.htm For a more comprehensive chemistry directory, please visit the CHEMISTRY WEBERCISES DIRECTORY at: http://murov.info/webercises.htm
Tetrahedral structure at Alexander Graham Bell Museum, Nova Scotia	Contents	Kitten admiring model of nepatalactone (catnip)

I. Properties of Organic Cmpds.	IV. Organic Chem. Directories	VII. Suppliers, Structure Search
A. Physical Properties	V. Educational Sites and Resources	VIII. Journals
B. Spectra (Collections)	A. Chemical Education Journals	IX. Special Topics
C. Search for Cmpds. from Properties	B. Concepts and Virtual Textbooks, Texts	A. Combinatorial Chemistry
D. Solvent Properties	C. Spectroscopy	B. Coordination Compounds
E. Thermodynamic Properties	D. Chromatography	C. Green Chemistry
F. Equilibrium Constants, pK_a	E. PowerPoint Presentations	D. Microwave Synthesis
G. Electronegativity	F. Concepts, Tutorials	E. Nano Topics
H. Hammett Constants	G. Exercises with some tutorials	F. Organometallics
I. Toxicology and Hazards	H. Laboratory Techniques	G. Pharmaceutical Chem.
II. Synthesis and Reactions	I. Laboratory Experiments	H. Photosynthesis
III. Molecular Models	J. Safety	I. Peptides and Proteins
A. Drawing Programs	K. Periodic Table	J. Polymers
B. Collections	L. Reaction-Map of Organic Chemistry	K. Smell and Olfaction
C. Molecular Modeling Info and Links	M. History, Eminent Chemists	L. Sugars
	VI. Searches - Keyword and Journals	M. Smart Phone Apps

Newest entries are in red or indicated with a red asterisk.

I. Properties of Organic Compounds

    A. Physical Properties

        1. Tabulation + MSDS
            Acros - http://www.acros.com/portal/alias__Rainbow/lang__en/tabID__21/DesktopDefault.aspx
            Aldrich, Sigma - http://www.sigmaaldrich.com/
            Alpha Chemical   http://www.alfa.com/alf/laboratory_chemical_suppliers.htm
            ChemExper Chem. Directory - http://www.chemexper.com/
            ChemFinder Web Server - http://chemfinder.cambridgesoft.com/
            Chemidplus - http://chem.sis.nlm.nih.gov/chemidplus/
                        or http://chem.sis.nlm.nih.gov/chemidplus/chemidlite.jsp
            Chemindex - http://ccinfoweb.ccohs.ca/chemindex/search.html
            Chemspider - http://www.chemspider.com/
                                http://www.chemspider.com/SimpleSearch.aspx
            EMD Chemicals - http://www.emdchemicals.com/corporate/emd_corporate.asp
            Fisher - http://www.fishersci.com/ecomm/servlet/cmstatic?storeId=10652&ddkey=http:home
            TCI America - http://www.tciamerica.com/brochure/catalog.html
            Wikipedia - http://en.wikipedia.org/wiki/List_of_organic_compounds
                             http://en.wikipedia.org/wiki/List_of_inorganic_compounds
            Chemical Book - http://www.chemicalbook.com/

     2. MSDS
           Avantor - http://www.avantormaterials.com/
            MSDS Solutions - http://www.msds.com/
            Vermont Safety Information Resources, Inc. - http://hazard.com/msds/
                        Siri MSDS (and toxicology) http://siri.org/msds/
            MSDSprovider - http://www.msdsprovider.com/

B. Spectra (Collections)

         1. IR - Liquid or Solution
            Acros - http://www.acros.com/portal/alias__Rainbow/lang__en/tabID__21/DesktopDefault.aspx
            Aldrich - http://www.sigmaaldrich.com/ (click on compound and then on Safety and Documentation to check for availability)
            NIMC site - http://riodb01.ibase.aist.go.jp/sdbs/cgi-bin/cre_index.cgi?lang=eng
            NIST site - http://webbook.nist.gov/chemistry/
            RSC - http://www.le.ac.uk/spectraschool/
            fee based - https://ftirsearch.com/default3.htm

        2. IR - Gas Phase
            NIST - http://webbook.nist.gov/chemistry/
            ANSYCO - http://www.ansyco.de/CMS/frontend/index.php?idcatside=124

3. IR - Predicted
Bio-Rad - http://www.knowitall.com/academic/welcome.asp

        4. HNMR - Experimental
            Aldrich - http://www.sigmaaldrich.com/ (click on compound and then on Safety and Documentation to check for availability)
            NIMC site - http://riodb01.ibase.aist.go.jp/sdbs/cgi-bin/cre_index.cgi?lang=eng

            RSC - http://www.le.ac.uk/spectraschool/
            Solvents - http://www.alsnotebook.com/chlorformtraces.html
            human metabolites - http://hmdb.ca/
           bioorganics - http://mmcd.nmrfam.wisc.edu/mmcdbrowse.html

        5. HNMR - Calculated
            ChemExper Chem Directory - http://www.chemexper.com/
            nmrdb - http://www.nmrdb.org/

        6. ¹³CNMR - Experimental
            Aldrich - http://www.sigmaaldrich.com/   (click on compound and then on Safety and Documentation to check for availability)
            NIMC site - http://riodb01.ibase.aist.go.jp/sdbs/cgi-bin/cre_index.cgi?lang=eng
            RSC - https://www.le.ac.uk/spectraschool/

        7. Mass
            NIMC site - http://riodb01.ibase.aist.go.jp/sdbs/cgi-bin/cre_index.cgi?lang=eng
            NIST site - http://webbook.nist.gov/chemistry/
            RSC - http://www.le.ac.uk/spectraschool/

            Pherobase - http://www.pherobase.com/database/compound/compounds-index.php
            RSC - http://www.chemsoc.org/networks/learnnet/spectra/index2.htm
            human metabolites - http://hmdb.ca/

        8. UV-Vis
            NIST site - http://webbook.nist.gov/chemistry/
            OMLC - http://omlc.ogi.edu/spectra/PhotochemCAD/html/alpha.html
            RSC - http://www.le.ac.uk/spectraschool/

9. Bibliography - http://library.buffalo.edu/libraries/asl/guides/spectra.html

10. Polymer spectra - http://pslc.uwsp.edu/

    C. Search for Compounds from Properties

        Acros - http://www.acros.com/portal/alias__Rainbow/lang__en/tabID__21/DesktopDefault.aspx
                    accepts - formula, structure, molecular mass, bp, mp, refractive index, density, ir
        Aldrich (navigate to substructure search) - http://www.sigmaaldrich.com/
            or click on "more options" at the bottom left of:
            http://www.sigmaaldrich.com/catalog/search/SubstructureSearchPage
                    accepts - formula, structure, molecular mass, mp, bp, density
        ChemExper Chem Directory - http://www.chemexper.com/
                    accepts - formula, structure, molecular mass, bp, mp, refractive index, density, ir, nmr
        Chemspider - http://www.chemspider.com/PropertiesSearch.aspx
                    accepts - formula, molecular mass
        Melting point and molecular mass search: http://chem.sis.nlm.nih.gov/chemidplus/
                    accepts - formula, mp, bp
        Organic Chemistry Data Base - http://www.colby.edu/chemistry/cmp/cmp.html
                    accepts - formula, molecular mass, mp, bp, density, refractive index, ir, ms
        NIMC site - http://riodb01.ibase.aist.go.jp/sdbs/cgi-bin/cre_index.cgi?lang=eng
                    accepts - formula, molecular mass, ir, nmr, ms
        Polymers - http://www.matweb.com/
                    *   http://www.goodfellowusa.com/
        Knovel Critical Tables - Free registration required (on registration form,
                http://www.knovel.com/web/portal/free_titles , or after clicking on
            http://www.knovel.com/web/portal/browse/display?_EXT_KNOVEL_DISPLAY_bookid=761
            select the Table for Basic Physical Properties of Chemical Compounds and register.
                Use the sort by ascending or descending order capability for any parameter and also the filter capability.
        Search for structure from name - http://www.commonchemistry.org/

   D. Solvent Properties
       http://murov.info/orgsolvents.htm
        http://organicdivision.org/organic_solvents.html
        http://solvdb.ncms.org/solvdb.htm
        http://www.wiredchemist.com/chemistry/data/physical_character_solvents.html
        http://www.cem.msu.edu/~reusch/OrgPage/tables.htm
        Knovel Critical Tables - Free registration required (on registration form,
                http://www.knovel.com/web/portal/free_titles , or after clicking on
            http://www.knovel.com/web/portal/browse/display?_EXT_KNOVEL_DISPLAY_bookid=761
            select the Table for Basic Physical Properties of Common Solvents and register.
         nmr of deuterated solvents
            http://verzeichnisse.freepage.de/chemistry/spec_en.htm
            http://www.wiredchemist.com/chemistry/data/common_nmr_solvents.html

    E. Thermodynamic Properties
        NIST site - http://webbook.nist.gov/chemistry/
        Wired Chemist - http://www.wiredchemist.com/chemistry/data/entropies_organic.html
        Knovel Critical Tables - Free registration required (on registration form,
                http://www.knovel.com/web/portal/free_titles , or after clicking on
            http://www.knovel.com/web/portal/browse/display?_EXT_KNOVEL_DISPLAY_bookid=761
            select the Table for Enthalpies and Entropies of Formation of Organic Compounds (Condensed or Gas)
                or Reaction Thermodynamics and Equilibrium Constants and register.
          fee based, Infotherm - http://www.fiz-chemie.de/infotherm/servlet/infothermSearch
       Wolframalpha - http://www.wolframalpha.com/
       PPSI - http://www.eqi.ethz.ch/en/

    F. Equilibrium Constants, pK_a, Solubility, Indicators
        http://www.chem.wisc.edu/areas/reich/pkatable/index.htm
        http://www.csudh.edu/oliver/chemdata/data-ka.htm
        http://research.chem.psu.edu/brpgroup/pKa_compilation.pdf
        http://www.zirchrom.com/organic.htm
        http://www2.lsdiv.harvard.edu/labs/evans/pdf/evans_pKa_table.pdf
        http://www.wiredchemist.com/chemistry/data/base_constants.html
        http://www.wiredchemist.com/chemistry/data/acid_constants.html
        http://www.wiredchemist.com/chemistry/data/solubility_product_constants.html

        Knovel Critical Tables - Free registration required (on registration form,
                http://www.knovel.com/web/portal/free_titles , or after clicking on
            http://www.knovel.com/web/portal/browse/display?_EXT_KNOVEL_DISPLAY_bookid=761
            select the Table for Reaction Thermodynamics and Equilibrium Constants and register.

       Solubility data - http://srdata.nist.gov/solubility/version_his.aspx
        http://en.wikipedia.org/wiki/Solubility_table

Acid base indicators -
concepts - http://www.chemguide.co.uk/physical/acidbaseeqia/indicators.html

properties - http://antoine.frostburg.edu/chem/senese/101/acidbase/indicators.shtml

http://en.wikipedia.org/wiki/PH_indicator

http://ifs.massey.ac.nz/resources/chemistry/dissociation/indicators.htm

G. Electronegativity
http://www.meta-synthesis.com/webbook/36_eneg/electroneg.html

    H. Hammett Constants
        http://www.wiredchemist.com/chemistry/data/hammett_sigma_constants.html
        http://old.iupac.org/publications/pac/1997/pdf/6912x2497.pdf

    I. Toxicology and Hazards (also check MSDS sites above)
        ATSDR - http://www.atsdr.cdc.gov/substances/index.asp
        Chemical Database - http://ull.chemistry.uakron.edu/erd/
        EDF Scorecard - http://www.scorecard.org/chemical-profiles/
        NIOSH - http://www.cdc.gov/niosh/npg/npgsyn-a.html
        Toxnet - http://www.nlm.nih.gov/pubs/factsheets/toxnetfs.html
        PubChem - http://pubchem.ncbi.nlm.nih.gov/
        CIS - http://www.ilo.org/legacy/english/protection/safework/cis/products/icsc/dtasht/index.htm
          Knovel Critical Tables - Free registration required (on registration form,
                http://www.knovel.com/web/portal/free_titles , or after clicking on
            http://www.knovel.com/web/portal/browse/display?_EXT_KNOVEL_DISPLAY_bookid=761
            select the Table for Safety Properties of Common Solvents and register.
         Toxnet - http://toxnet.nlm.nih.gov/
        Toxin database - http://www.t3db.org/
            Cancer screening
                NCI - http://nci.cambridgesoft.com/
                http://msds.chem.ox.ac.uk/carcinogens.html
                http://www.cdc.gov/niosh/npg/nengapdx.html
            Other concerns of chemicals
                     Household and Commonly Encountered Chemicals -
                        http://householdproducts.nlm.nih.gov/
                        http://toxtown.nlm.nih.gov/text_version/chemicals.php
                     Food Additives - http://www.access.gpo.gov/nara/cfr/waisidx_03/21cfrv3_03.html
                     Bioactives - http://chembank.broad.harvard.edu/
                     Structural Database of Allergenic Proteins -
                          http://www.allermatch.org/database.html
                          http://fermi.utmb.edu/SDAP/
                     Drug Properties and Structure for Drug Design: Links to Data Bases -
                          http://www.cheminformatics.org/
                        http://drugbank.ca/