68 sites in Chemical Databases
CHEMnetBASE
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Online access to major chemical reference works from Chapman & Hall/CRC including Combined Chemical Dictionary (CCD), The Handbook of Chemistry & Physics, Polymers: A Property Database, Properties of Organic Compounds.
http://chemnetbase.com
ChemBank
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Initiative for Chemical Genetics. Freely available collection of data about small molecules (over 2000 compounds) and resources for studying their properties, especially their effects on biology.
http://chembank.med.harvard.edu/
ChemIDplus
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A free database of 350000 chemical compounds. Records consist of name, synonyms, CAS number, molecular formula, and direct links to biomedical resources. Included also over 100000 structures. Searchable by substructure with free Chime plugin.
http://chem.sis.nlm.nih.gov/chemidplus/
ChemRef
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Database of organic compounds that have been identified in petroleum materials. Includes chromatographic separations, mass spectra, chemical structures, molecular weight, etc.
http://www.chemref.com
Chemical Abstracts Service (CAS)
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Provides pathways to published research in the world's journal and patent literature through tools such as SciFinder, SciFinder Scholar and STN. CAS databases provide access to over 25 million documents, 26 million chemical substances, and 56 million sequences.
http://www.cas.org/
EuroSpec
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International spectroscopic data bank and archive project for spectroscopic and associated data, from peer reviewed publications, with link to the chemical abstracts register.
http://www.is-db.org/eurospec/
Indiana University Molecular Structure Center
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Small molecule database of structures that have primarily been determined using single crystal X-ray diffraction. Features JAVA applets that can be used to orient and examine the molecule, and a dedicated Beowulf computer system to generate high quality rendered images. Currently contains over 2,500 molecules.
http://www.iumsc.indiana.edu
PubChem
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Free database of chemical structures of small organic molecules and information on their biological activities. Linked with NIH PubMed/Entrez information retrieval system.
http://pubchem.ncbi.nlm.nih.gov/
RADEN Data Bank
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Is designed for compilation of experimental researches and calculations of the RADiative and ENergy parameters defining the distribution of intensity in electronic and vibrational spectra of diatomic molecules.
http://www.elch.chem.msu.ru/raden/
SOLV-DB
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A free database of commercially available solvents searchable by many properties. Compiled by National Center for Manufacturing Sciences.
http://solvdb.ncms.org/
SPRESIweb - InfoChem GmbH
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The new SpresiWeb developed by InfoChem is an integrated scientific database containing over 4.5 million molecules, 3.5 million reactions, 380,000 references, 98,000 patents covering years 1974 - 1999.
http://www.infochem.de
STM Data
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Data collections from Science, Technology and Medicine (STM): AntiBase (natural compound identifier), AmicBase (antimicrobial activity verifier), Mass Spectra (MS) of Pharmaceuticals and Agrochemicals, Infrared Spectra (IR) of Polymers.
http://www.wiley-vch.de/stmdata/
See also
The category Chemical Databasesin other languages