N-Phenethylbenzamide

HCID 95083CAS 3278-14-6

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Basic information

Standard SMILES: O=C(NCCc1ccccc1)c1ccccc1
InChIKey: DAVRGGJTJDTVQT-UHFFFAOYSA-N
Molecular formula: C15H15NO
Average molar mass: 225.28 g/mol
Monoisotopic mass: 225.1153641

Overview

has antioxidant activity; structure in first source

Names & identifiers

Preferred name: N-Phenethylbenzamide
IUPAC: N-(2-phenylethyl)benzamide
English name: N-Phenethylbenzamide
Molecular formula: C15H15NO
Molecular weight: 225.29

Names & synonyms

N-phenethylbenzamide3278-14-6N-(2-Phenylethyl)benzamideBenzamide, N-(2-phenylethyl)-DTXSID90186443riparin ARefChem:927314BVC55Y6H9MDTXCID00108934608-784-1N-phenethyl-benzamide4-(DICHLOROMETHYL)PYRIDINE HCL

Show more names

Solinasine 26Solina New Impurity 21N-phenyl benzamide impuritySolifenaxin succinate SM1Z3N-phenethylbenzamide, 10 mM in DMSO

MFCD00441484Solifenacin impurity ASolifenacin Impurity 24NSC 16618NSC 43723N-phenethyl benzamideN-(2-Phenethyl)benzamiden-benzoyl-2-phenylethylamine

Database identifiers

CAS: 3278-14-6
PubChem CID: 95083
DTXSID: DTXSID90186443
ChEMBL: CHEMBL4852435
EC Number: 608-784-1
Nikkaji: J432.487K

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 29.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 4
Heavy atoms: 17
Formal charge: 0
Complexity: 227

Physicochemical properties

Melting point: 117 · 117-118 °C
Boiling point: 439 · 439.0±24.0 °C(Predicted)
Density: 1.088 · 1.088±0.06 g/cm3(Predicted)
storage temp.: 2 · Storage temp. 2-8°C
solubility: soluble in Deuterated Chloroform
form: Powder
pka: 14.56 · 14.56±0.46(Predicted)
color: White
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338