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Home > Nitro Compounds > 13272-12-3
13272-12-3 | Acetamide, N-[4-nitro-3-(1-piperidinyl)phenyl]-
CAS No: 13272-12-3 Catalog No: AG00112O MDL No:
Product Description
Catalog Number:
AG00112O
Chemical Name:
Acetamide, N-[4-nitro-3-(1-piperidinyl)phenyl]-
CAS Number:
13272-12-3
Molecular Formula:
C13H17N3O3
Molecular Weight:
263.2924
IUPAC Name:
N-(4-nitro-3-piperidin-1-ylphenyl)acetamide
InChI:
InChI=1S/C13H17N3O3/c1-10(17)14-11-5-6-12(16(18)19)13(9-11)15-7-3-2-4-8-15/h5-6,9H,2-4,7-8H2,1H3,(H,14,17)
InChI Key:
JVXGTLQYQJHGCI-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(c(c1)N1CCCCC1)[N+](=O)[O-]
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.127g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.297g/mol
Monoisotopic Mass:
263.127g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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