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Home > Nitro Compounds > 89634-61-7
89634-61-7 | Acetamide, N-[2-nitro-4-(3-pyridinylmethyl)phenyl]-
CAS No: 89634-61-7 Catalog No: AG003W5Y MDL No:
Product Description
Catalog Number:
AG003W5Y
Chemical Name:
Acetamide, N-[2-nitro-4-(3-pyridinylmethyl)phenyl]-
CAS Number:
89634-61-7
Molecular Formula:
C14H13N3O3
Molecular Weight:
271.2713
IUPAC Name:
N-[2-nitro-4-(pyridin-3-ylmethyl)phenyl]acetamide
InChI:
InChI=1S/C14H13N3O3/c1-10(18)16-13-5-4-11(8-14(13)17(19)20)7-12-3-2-6-15-9-12/h2-6,8-9H,7H2,1H3,(H,16,18)
InChI Key:
JNEZZNISGGQHEJ-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cc1[N+](=O)[O-])Cc1cccnc1
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.096g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
271.276g/mol
Monoisotopic Mass:
271.096g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
87.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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