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N-(4-(2-Oxoacetyl)phenyl)acetamide

HCID 321733
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Basic information

CAS
67014-06-6
Standard SMILES
CC(=O)Nc1ccc(C(=O)C=O)cc1
InChIKey
MREMDXZTQRBMOE-UHFFFAOYSA-N
Molecular formula
C10H9NO3
Average molar mass
191.18 g/mol
Monoisotopic mass
191.05824315

Names & identifiers

Preferred name
N-(4-(2-Oxoacetyl)phenyl)acetamide
IUPAC
N-(4-oxaldehydoylphenyl)acetamide
English name
N-(4-(2-OXOACETYL)PHENYL)ACETAMIDE
Molecular formula
C10H9NO3
Molecular weight
191.18

Names & synonyms

67014-06-6N-(4-(2-OXOACETYL)PHENYL)ACETAMIDEN-[4-(Oxoacetyl)phenyl]acetamideAcetamide, N-[4-oxoacetyl)phenyl]-NSC2749464-AcetylaminophenylglyoxalSCHEMBL7572624DTXSID30313695Acetamide, N-[4-(oxoacetyl)phenyl]-AKOS005067577AB14115NSC-274946
Show more names
Acetamide, N-[4-(2-oxoacetyl)phenyl]-

Database identifiers

CAS
67014-06-6
PubChem CID
321733
DTXSID
DTXSID30313695

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
63.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
14
Formal charge
0
Complexity
242

Physicochemical properties

Melting point
133 · 133-135 °C
Boiling point
401.5 · 401.5±37.0 °C(Predicted)
Density
1.263 · 1.263±0.06 g/cm3(Predicted)
pka
14.35 · 14.35±0.70(Predicted)

Related reactions

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Compound notes

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