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Home > Nitro Compounds > 835627-54-8
835627-54-8 | Acetamide, N-acetyl-N-(4-methoxy-3,5-dinitrophenyl)-
CAS No: 835627-54-8 Catalog No: AG0057KQ MDL No:
Product Description
Catalog Number:
AG0057KQ
Chemical Name:
Acetamide, N-acetyl-N-(4-methoxy-3,5-dinitrophenyl)-
CAS Number:
835627-54-8
Molecular Formula:
C11H11N3O7
Molecular Weight:
297.2209
IUPAC Name:
N-acetyl-N-(4-methoxy-3,5-dinitrophenyl)acetamide
InChI:
InChI=1S/C11H11N3O7/c1-6(15)12(7(2)16)8-4-9(13(17)18)11(21-3)10(5-8)14(19)20/h4-5H,1-3H3
InChI Key:
PYRPMZKSLVLGND-UHFFFAOYSA-N
SMILES:
COc1c(cc(cc1[N+](=O)[O-])N(C(=O)C)C(=O)C)[N+](=O)[O-]
Properties
Complexity:
418
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.06g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.223g/mol
Monoisotopic Mass:
297.06g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
138A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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