Basic information
- CAS
101904-51-2- Standard SMILES
O=C(O)c1cc2[nH]c3ccccc3c(=O)c2cc1Nc1ccccc1- InChIKey
HKQTUROKKAXNFP-UHFFFAOYSA-N- Molecular formula
- C20H14N2O3
- Average molar mass
- 330.3 g/mol
- Monoisotopic mass
- 330.10044231
Names & identifiers
- Preferred name
- 3-Acridinecarboxylic acid, 9,10-dihydro-9-oxo-2-(phenylamino)-
- IUPAC
- 2-anilino-9-oxo-10H-acridine-3-carboxylic acid
- English name
- 9,10-Dihydro-9-oxo-2-phenylaminoacridine-3-carboxylic acid
- Molecular formula
- C20H14N2O3
- Molecular weight
- 330.34
Names & synonyms
101904-51-23-Acridinecarboxylic acid, 9,10-dihydro-9-oxo-2-(phenylamino)-DTXSID8073007RefChem:496608DTXCID50326582-(phenyl)amino-3-carboxy-9(10H)acridone2-Anilino-9-oxo-9,10-dihydroacridine-3-carboxylic acidSCHEMBL109864929,10-Dihydro-9-oxo-2-phenylaminoacridine-3-carboxylic acid
Database identifiers
- CAS
101904-51-2- PubChem CID
- 11067475
- DTXSID
DTXSID8073007- Nikkaji
- J39.747D
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 517
Physicochemical properties
- EPA Substance Registry System
- 3 · 3-Acridinecarboxylic acid, 9,10-dihydro-9-oxo-2-(phenylamino)- (101904-51-2)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information3-Acridinecarboxylic acid, 9,10-dihydro-9-oxo-2-(phenylamino)-: INACTIVE
Related reactions
2 records
Compound notes
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