2-methyl-N-(1-phenylethyl)benzamide
Basic information
- CAS
17537-43-8- Standard SMILES
Cc1ccccc1C(=O)NC(C)c1ccccc1- InChIKey
FGJJSSFDJWWUNG-UHFFFAOYSA-N- Molecular formula
- C16H17NO
- Average molar mass
- 239.31 g/mol
- Monoisotopic mass
- 239.13101417
Names & identifiers
- Preferred name
- 2-methyl-N-(1-phenylethyl)benzamide
- IUPAC
- 2-methyl-N-(1-phenylethyl)benzamide
- English name
- 2-methyl-N-(1-phenylethyl)benzamide
- Molecular formula
- C16H17NO
- Molecular weight
- 239.31
Names & synonyms
2-methyl-N-(1-phenylethyl)benzamideMFCD0043412417537-43-8SCHEMBL16348943CC(c1ccccc1)NC(=O)c1ccccc1CSTK068469AKOS000489061AKOS0032387482METHYLN(1PHENYLETHYL)BENZAMIDEN(1PHENYLETHYL)2METHYLBENZAMIDEST035237ZINC000000046452
Show more names
Benzamide, 2-methyl-N-(1-phenylethyl)-
ZINC000000046453(2-methylphenyl)-N-(phenylethyl)carboxamide(2METHYLPHENYL)N(PHENYLETHYL)CARBOXAMIDECC1=CC=CC=C1C(=O)NC(C)C2=CC=CC=C2SR-01000042733SR-01000042733-1Z31450306
Database identifiers
- CAS
17537-43-8- PubChem CID
- 3347151
- EC Number
- 159-610-1
- Nikkaji
- J2.814.024J
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 270
Physicochemical properties
- Boiling point
- 403.7 · 403.7±34.0 °C(Predicted)
- Density
- 1.068 · 1.068±0.06 g/cm3(Predicted)
- pka
- 14.05 · 14.05±0.46(Predicted)
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, 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 CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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