Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 8 results

Search term: HCFRWBBJISAZNK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
133210

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C7H12O3/c8-6-3-1-5(2-4-6)7(9)10/h5-6,8H,1-4H2,(H,9,10)
C7H12O3144.1684109101647
10466932

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C7H12O3/c8-6-3-1-5(2-4-6)7(9)10/h5-6,8H,1-4H2,(H,9,10)/t5-,6-
C7H12O3144.1684725901
10466888

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C7H12O3/c8-6-3-1-5(2-4-6)7(9)10/h5-6,8H,1-4H2,(H,9,10)/t5-,6+
C7H12O3144.1684585313
19986764

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C7H12O3/c8-6-3-1-5(2-4-6)7(9)10/h5-6,8H,1-4H2,(H,9,10)/p-1/t5-,6-
C7H11O3143.1613212
84492193

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C7H12O3/c8-6-3-1-5(2-4-6)7(9)10/h5-6,8H,1-4H2,(H,9,10)/t5?,6-
C7H12O3144.16843200
58784295

0 of 2 defined stereocentres - 0/2 defined

Non-standard isotope
InChI=1/C7H12O3/c8-6-3-1-5(2-4-6)7(9)10/h5-6,8H,1-4H2,(H,9,10)/i3D2,4D2,6D
C7H7D5O3149.19922400
14057965

Charge

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C7H12O3/c8-6-3-1-5(2-4-6)7(9)10/h5-6,8H,1-4H2,(H,9,10)/p-1
C7H11O3143.1611200

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