N-(2-Acetylphenyl)acetamide

HCID 21306

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Basic information

CAS: 5234-26-4
Standard SMILES: CC(=O)Nc1ccccc1C(C)=O
InChIKey: YSZGCNKBKQQPAH-UHFFFAOYSA-N
Molecular formula: C10H11NO2
Average molar mass: 177.2 g/mol
Monoisotopic mass: 177.07897859

Names & identifiers

Preferred name: N-(2-Acetylphenyl)acetamide
IUPAC: N-(2-acetylphenyl)acetamide
English name: N-(2-ACETYL-PHENYL)-ACETAMIDE
Molecular formula: C10H11NO2
Molecular weight: 177.2

Names & synonyms

N-(2-Acetylphenyl)acetamide5234-26-42'-Acetamidoacetophenoneo-AcetamidoacetophenoneAcetamide, N-(2-acetylphenyl)-2'-Acetylacetanilide2'-(Acetylamino)acetophenoneF1K8P8A71NNSC-12469RefChem:1090946N-(2-acetyl-phenyl)-acetamideACETANILIDE, 2'-ACETYL-

Show more names

ACETOPHENONE, O-ACETYLAMINON-(2-ethanoylphenyl)ethanamideN-{2-[(2,2,2-d3)acetyl]phenyl}acetamide

MFCD00032277N-(2-acetylphenyl)acetamide-d3Acetamido-2 acetophenone [French]o-AcetylaminoacetophenoneAcetamido-2 acetophenoneNSC 12469BRN 09089502-ACETAMIDOACETOPHENONE

Database identifiers

CAS: 5234-26-4
PubChem CID: 21306
DTXSID: DTXSID80200369
UNII: F1K8P8A71N
Nikkaji: J79.112A

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 46.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 13
Formal charge: 0
Complexity: 213

Experimental & physicochemical properties

SpringerMaterials PropertiesChemical shift

LogP1.4

Physicochemical properties

Melting point: 77 °C · 77 °C(Solv: ethyl ether (60-29-7))
Boiling point: 367.4 · 367.4±25.0 °C(Predicted)
Density: 1.15 · 1.150±0.06 g/cm3(Predicted)
storage temp.: Store at room temperature
pka: 14.56 · 14.56±0.70(Predicted)
Appearance: Off-white to light yellow Solid
FDA UNII: 1 K8P8A71N · F1K8P8A71N
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H312-H332
Precautionary statements: 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
HS Code: 2924297099 · 2924297099

Safety & regulation

Safety data

hs_code: 2924297099
Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H302-H312-H332
Precautionary statements: P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501