Methyl 4-[(2-bromobenzoyl)amino]benzoate
Basic information
- CAS
304664-13-9- Standard SMILES
COC(=O)c1ccc(NC(=O)c2ccccc2Br)cc1- InChIKey
IKJQHRCSOBEEBP-UHFFFAOYSA-N- Molecular formula
- C15H12BrNO3
- Average molar mass
- 334.16 g/mol
- Monoisotopic mass
- 333.00006
Names & identifiers
- Preferred name
- Methyl 4-[(2-bromobenzoyl)amino]benzoate
- IUPAC
- methyl 4-[(2-bromobenzoyl)amino]benzoate
Names & synonyms
methyl 4-[(2-bromobenzoyl)amino]benzoateZINC101473ZINC00101473CBDivE_015078SCHEMBL21929414MFCD00423312STK064479AKOS000486491COC(=O)c1ccc(cc1)NC(=O)c1ccccc1Br304664-13-9ST010601ZINC000000101473
Show more names
METHYL 4-(2-BROMOBENZAMIDO)BENZOATEMETHYL4((2BROMOBENZOYL)AMINO)BENZOATEAB00079299-01methyl 4-[(2-bromophenyl)carbonylamino]benzoateSR-01000203411METHYL4((2BROMOPHENYL)CARBONYLAMINO)BENZOATESR-01000203411-1COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2Br
Database identifiers
- CAS
304664-13-9- PubChem CID
- 710567
- EC Number
- 152-213-4
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 353
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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