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 6 results

Search term: BXXPKNCQABBGDK (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2005862

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C8H9BrO3/c9-5-1-4-6(10)2-3(5)7(4)8(11)12/h3-5,7H,1-2H2,(H,11,12)
C8H9BrO3233.0592611500
10038021

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H9BrO3/c9-5-1-4-6(10)2-3(5)7(4)8(11)12/h3-5,7H,1-2H2,(H,11,12)/p-1/t3-,4-,5-,7-/m1/s1
C8H8BrO3232.05192200
10038022

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H9BrO3/c9-5-1-4-6(10)2-3(5)7(4)8(11)12/h3-5,7H,1-2H2,(H,11,12)/t3-,4-,5-,7-/m1/s1
C8H9BrO3233.05932100
10043550

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H9BrO3/c9-5-1-4-6(10)2-3(5)7(4)8(11)12/h3-5,7H,1-2H2,(H,11,12)/t3-,4-,5-,7+/m1/s1
C8H9BrO3233.05932100
10043549

Charge

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C8H9BrO3/c9-5-1-4-6(10)2-3(5)7(4)8(11)12/h3-5,7H,1-2H2,(H,11,12)/p-1/t3-,4-,5-,7+/m1/s1
C8H8BrO3232.05191100

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