Basic information
- CAS
84-43-5- Standard SMILES
O=C(O)c1cc2ccc3c4ccccc4[nH]c3c2cc1O- InChIKey
ONMDNQFBIVCMAS-UHFFFAOYSA-N- Molecular formula
- C17H11NO3
- Average molar mass
- 277.27 g/mol
- Monoisotopic mass
- 277.07389321
Names & identifiers
- Preferred name
- 2-Hydroxy-11H-benzo[a]carbazole-3-carboxylic acid
- IUPAC
- 2-hydroxy-11H-benzo[a]carbazole-3-carboxylic acid
- English name
- 2-hydroxy-11H-benzo[a]carbazole-3-carboxylic acid
- Molecular formula
- C17H11NO3
- Molecular weight
- 277.27
Names & synonyms
84-43-52-hydroxy-11H-benzo[a]carbazole-3-carboxylic acid2-Hydroxy-11H-benzo(a)carbazole-3-carboxylic acidEINECS 201-529-1DTXSID80232887NSC 58411RefChem:87345DTXCID10155378201-529-1CHEMBL490409NSC-5841111H-Benzo[a]carbazole-3-carboxylic acid, 2-hydroxy-
Show more names
Benzacylic acid2-Hydroxybenzocarbazole-3-CarboxylicAcid
NSC58411Pink 3B TolylamideOprea1_34124676KBX76TT4SCHEMBL1247817SCHEMBL31832782BDBM502639062-Hydroxy-3-carboxybenzo[a]carbazole
Database identifiers
- CAS
84-43-5- PubChem CID
- 66531
- DTXSID
DTXSID80232887- ChEMBL
CHEMBL490409- UNII
- 76KBX76TT4
- EC Number
- 201-529-1
- Nikkaji
- J192.616K
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 73.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 426
Physicochemical properties
- Boiling point
- 578.7 · 578.7±40.0 °C(Predicted)
- Density
- 1.531 · 1.531±0.06 g/cm3(Predicted)
- pka
- 3.21 · 3.21±0.30(Predicted)
- FDA UNII
- 76 KBX76TT4 · 76KBX76TT4
Chemistry & industry
Suppliers2 total
Alfa Chemistry+1-5166625404 · [email protected]
河南威梯希化工科技有限公司0371-53370800 18037197114 · [email protected]
Related reactions
2 records
Compound notes
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