Basic information
- CAS
736-40-3- Standard SMILES
CCOC(=O)c1ccc(NC(=O)c2ccccc2)cc1- InChIKey
XFPYCMXNXPPZRV-UHFFFAOYSA-N- Molecular formula
- C16H15NO3
- Average molar mass
- 269.29 g/mol
- Monoisotopic mass
- 269.10519334
Names & identifiers
- Preferred name
- Ethyl 4-(benzoylamino)benzoate
- IUPAC
- ethyl 4-benzamidobenzoate
- English name
- 4-(Benzoylamino)benzoic acid ethyl ester
- Molecular formula
- C16H15NO3
- Molecular weight
- 269.3
Names & synonyms
736-40-34'-CarbethoxybenzanilideEthyl p-benzamidobenzoateethyl 4-(benzoylamino)benzoateBENZOIC ACID, p-BENZAMIDO-, ETHYL ESTERV4SGQ38AJ1Benzoic acid, 4-(benzoylamino)-, ethyl esterNSC 408046AI3-30015N-BENZOYLBENZOCAINEUNII-V4SGQ38AJ1NSC-408046
Show more names
4-(Benzoylamino)benzoic acid ethyl ester
ethyl 4-[(phenylcarbonyl)amino]benzoateDTXSID10223788N-(4-(ETHOXYCARBONYL)PHENYL)BENZAMIDEETHYL 4-((PHENYLCARBONYL)AMINO)BENZOATERefChem:138739DTXCID40146279ethyl 4-benzamidobenzoate4-Benzoylamino-benzoic acid ethyl ester
Database identifiers
- CAS
736-40-3- PubChem CID
- 12914
- DTXSID
DTXSID10223788- ChEMBL
CHEMBL1330960- UNII
- V4SGQ38AJ1
- EC Number
- 653-653-4
- Nikkaji
- J41.221J
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 329
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical structure
Physicochemical properties
- CAS DataBase Reference
- 736 · 736-40-3
- FDA UNII
- 4 SGQ38AJ1 · V4SGQ38AJ1
- Symbol(GHS)
- 9 · GHS09
- Signal word
- Warning
- Hazard statements
- 400 · H400
- Precautionary statements
- 273 · P273-P391-P501
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)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS09
- Hazard statements
- H400
- Precautionary statements
- P273-P391-P501
Chemistry & industry
Applications
UsesAgricultural chemical.
Upstream & downstream products
Downstream products
Suppliers2 total
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
Related reactions
1 records
Compound notes
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