N-(2-Benzoyl-4-nitrophenyl)-2-chloroacetamide

HCID 88706
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Basic information

CAS
20821-91-4
Standard SMILES
O=C(CCl)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1
InChIKey
ZHJLHAOWFYEIOC-UHFFFAOYSA-N
Molecular formula
C15H11ClN2O4
Average molar mass
318.71 g/mol
Monoisotopic mass
318.04073451

Names & identifiers

Preferred name
N-(2-Benzoyl-4-nitrophenyl)-2-chloroacetamide
IUPAC
N-(2-benzoyl-4-nitrophenyl)-2-chloroacetamide
English name
N-(2-benzoyl-4-nitrophenyl)-2-chloroacetamide
Molecular formula
C15H11ClN2O4
Molecular weight
318.71

Names & synonyms

20821-91-4N-(2-Benzoyl-4-nitrophenyl)-2-chloroacetamideEINECS 244-062-9DTXSID60174938RefChem:161672DTXCID8097429244-062-9N-(2-Benzoyl-4-nitrophenyl)-2-chloro-acetamideAcetamide, N-(2-benzoyl-4-nitrophenyl)-2-chloro-2-chloroacetamido-5-nitro benzophenoneNitrazepam Impurity 3starbld0003059
Show more names
N-(2-benzoyl-4-nitrophenyl)2-chloroacetamido-5-nitrobenzophenone
SCHEMBL11883066MFCD01026198AKOS0027891552-(2-chloroacetamido)-5-nitrobenzophenoneNS00026747ST510215692-chloro-N-[4-nitro-2-(phenylcarbonyl)phenyl]acetamide

Database identifiers

CAS
20821-91-4
PubChem CID
88706
DTXSID
DTXSID60174938
EC Number
244-062-9
Nikkaji
J225.343G

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
92 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
22

Physicochemical properties

Melting point
176 °C · 176 °C(Solv: ethanol (64-17-5))
Boiling point
581 · 581.0±50.0 °C(Predicted)
Density
1.423 · 1.423±0.06 g/cm3(Predicted)
pka
11.1 · 11.10±0.70(Predicted)

Chemistry & industry

Applications

UsesN-(2-Benzoyl-4-nitrophenyl)-2-chloro-acetamide is a chemical reagent used in the synthesis of nitropenzophenone derivatives.

Upstream & downstream products

Downstream products

Suppliers20 total

济南百隆化学有限公司[email protected] · [email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
HBCChem, Inc.+1-510-219-6317 · [email protected]
上海鑫凯化学科技有限公司021-58930698 15921516558 · [email protected]

Related reactions

1 records
New reaction record

Compound notes

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