N-Phenethylbenzamide
Basic information
- CAS
3278-14-6- 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 Ų
- 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
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Applications
UsesN-Phenethylbenzamide was used for the synthesis of deteurerium-labeled amides within microreactors.
Upstream & downstream products
Downstream products
Related reactions
20 records
Compound notes
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