7-chloro-3-cyano-8-(trifluoromethyl)-10H-phenoxazine-1-carboxylic acid
Basic information
- CAS
478298-97-4- Standard SMILES
N#Cc1cc2c(c(C(=O)O)c1)Nc1cc(C(F)(F)F)c(Cl)cc1O2- InChIKey
TXAPPAVIDKYUBF-UHFFFAOYSA-N- Molecular formula
- C15H6ClF3N2O3
- Average molar mass
- 354.67 g/mol
Names & identifiers
- Preferred name
- 7-chloro-3-cyano-8-(trifluoromethyl)-10H-phenoxazine-1-carboxylic acid
- IUPAC
- 7-chloro-3-cyano-8-(trifluoromethyl)-10H-phenoxazine-1-carboxylic acid
- English name
- 10H-Phenoxazine-1-carboxylic acid, 7-chloro-3-cyano-8-(trifluoromethyl)-
- Molecular formula
- C15H6ClF3N2O3
- Molecular weight
- 0
Names & synonyms
10H-Phenoxazine-1-carboxylic acid, 7-chloro-3-cyano-8-(trifluoromethyl)-
Database identifiers
- CAS
478298-97-4
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 82.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 1
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 564
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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