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Home > Nitro Compounds > 116496-81-2
116496-81-2 | Acetamide, N-(2-methoxy-6-nitrophenyl)-
CAS No: 116496-81-2 Catalog No: AG000CMG MDL No:
Product Description
Catalog Number:
AG000CMG
Chemical Name:
Acetamide, N-(2-methoxy-6-nitrophenyl)-
CAS Number:
116496-81-2
Molecular Formula:
C9H10N2O4
Molecular Weight:
210.1867
IUPAC Name:
N-(2-methoxy-4-methyl-6-nitrophenyl)acetamide
InChI:
InChI=1S/C10H12N2O4/c1-6-4-8(12(14)15)10(11-7(2)13)9(5-6)16-3/h4-5H,1-3H3,(H,11,13)
InChI Key:
DOEHGANMBXMZDY-UHFFFAOYSA-N
SMILES:
COc1cccc(c1NC(=O)C)[N+](=O)[O-]
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.08g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.216g/mol
Monoisotopic Mass:
224.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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