Basic information
- CAS
23279-64-3- Standard SMILES
CC(=O)NCCc1ccc(C(C)=O)cc1- InChIKey
MWPMMSVYHPAOIO-UHFFFAOYSA-N- Molecular formula
- C12H15NO2
- Average molar mass
- 205.25 g/mol
- Monoisotopic mass
- 205.11027872
Names & identifiers
- Preferred name
- n-[2-(4-Acetylphenyl)ethyl]acetamide
- IUPAC
- N-[2-(4-acetylphenyl)ethyl]acetamide
- English name
- 4-(2-(N-Acetylamino)ethyl)acetophenone
- Molecular formula
- C12H15NO2
- Molecular weight
- 205.25
Names & synonyms
23279-64-3n-[2-(4-acetylphenyl)ethyl]acetamide4-(2-(N-Acetylamino)ethyl)acetophenoneNSC416394'-(2-Acetamidoethyl)-acetophenoneN-[2-(4-Acetyl-phenyl)-ethyl]-acetamideSCHEMBL6329536DTXSID20945969MWPMMSVYHPAOIO-UHFFFAOYSA-NYAA27964NSC-41639AKOS033438683
Show more names
RMA-14Acetamide, N-[2-(4-acetylphenyl)ethyl]-2-[(3,4-dimethoxyphenyl)methyl-(4-methylphenyl)sulfonylamino]benzoic acid
CS-0225709N-[2-(4-Acetylphenyl)ethyl]ethanimidic acidEN300-124709Z1509166504N-(4-acetylphenethyl)acetamide;?4'-[2-(N-Acetylamino)-ethyl]-acetophenone;N-[2-(4-Acetylphenyl)-ethyl]-acetamide
Database identifiers
- CAS
23279-64-3- PubChem CID
- 237789
- DTXSID
DTXSID20945969
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 230
Physicochemical properties
- Melting point
- 99 · 99-101 °C
- Boiling point
- 214 · 214-216 °C(Press: 3 Torr)
- Density
- 1.064 · 1.064±0.06 g/cm3(Predicted)
- pka
- 16.09 · 16.09±0.46(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers3 total
Capot Chemical Co.,Ltd.+86-（0）57185586718 +86-13336195806 · [email protected]
山东诚创蓝海医药科技有限公司0531-58897130 15508676053 · [email protected]
Capot Chemical Co., Ltd+86 (0) 571 85 58 67 18
Related reactions
6 records
Compound notes
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