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5443-33-4 | N-(5-Chloro-2-nitrophenyl)acetamide
CAS No: 5443-33-4 Catalog No: AG003SDN MDL No:
Product Description
Catalog Number:
AG003SDN
Chemical Name:
N-(5-Chloro-2-nitrophenyl)acetamide
CAS Number:
5443-33-4
Molecular Formula:
C8H7ClN2O3
Molecular Weight:
214.6058
IUPAC Name:
N-(5-chloro-2-nitrophenyl)acetamide
InChI:
InChI=1S/C8H7ClN2O3/c1-5(12)10-7-4-6(9)2-3-8(7)11(13)14/h2-4H,1H3,(H,10,12)
InChI Key:
YWANGSCDWBUSBK-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]
NSC Number:
12464
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.015g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.605g/mol
Monoisotopic Mass:
214.015g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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