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160088-53-9 | Acetamide, N-(5-chloro-4-methoxy-2-nitrophenyl)-
CAS No: 160088-53-9 Catalog No: AG001RNR MDL No:MFCD00126497
Product Description
Catalog Number:
AG001RNR
Chemical Name:
Acetamide, N-(5-chloro-4-methoxy-2-nitrophenyl)-
CAS Number:
160088-53-9
Molecular Formula:
C9H9ClN2O4
Molecular Weight:
244.6318
MDL Number:
MFCD00126497
IUPAC Name:
N-(5-chloro-4-methoxy-2-nitrophenyl)acetamide
InChI:
InChI=1S/C9H9ClN2O4/c1-5(13)11-7-3-6(10)9(16-2)4-8(7)12(14)15/h3-4H,1-2H3,(H,11,13)
InChI Key:
UDVMKRHMXJOWQA-UHFFFAOYSA-N
SMILES:
COc1cc([N+](=O)[O-])c(cc1Cl)NC(=O)C
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.025g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.631g/mol
Monoisotopic Mass:
244.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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