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Home > Nitro Compounds > 88380-51-2
88380-51-2 | Acetamide, N-[5-methoxy-4-nitro-2-(phenylmethoxy)phenyl]-
CAS No: 88380-51-2 Catalog No: AG004IMG MDL No:
Product Description
Catalog Number:
AG004IMG
Chemical Name:
Acetamide, N-[5-methoxy-4-nitro-2-(phenylmethoxy)phenyl]-
CAS Number:
88380-51-2
Molecular Formula:
C16H16N2O5
Molecular Weight:
316.3086
IUPAC Name:
N-(5-methoxy-4-nitro-2-phenylmethoxyphenyl)acetamide
InChI:
InChI=1S/C16H16N2O5/c1-11(19)17-13-8-16(22-2)14(18(20)21)9-15(13)23-10-12-6-4-3-5-7-12/h3-9H,10H2,1-2H3,(H,17,19)
InChI Key:
KEQMZBDOALKPAT-UHFFFAOYSA-N
SMILES:
COc1cc(NC(=O)C)c(cc1[N+](=O)[O-])OCc1ccccc1
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.106g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
316.313g/mol
Monoisotopic Mass:
316.106g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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