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121879-23-0 | Benzamide, N-(6-aminohexyl)-4-nitro-
CAS No: 121879-23-0 Catalog No: AG00168H MDL No:
Product Description
Catalog Number:
AG00168H
Chemical Name:
Benzamide, N-(6-aminohexyl)-4-nitro-
CAS Number:
121879-23-0
Molecular Formula:
C13H19N3O3
Molecular Weight:
265.3083
IUPAC Name:
N-(6-aminohexyl)-4-nitrobenzamide
InChI:
InChI=1S/C13H19N3O3/c14-9-3-1-2-4-10-15-13(17)11-5-7-12(8-6-11)16(18)19/h5-8H,1-4,9-10,14H2,(H,15,17)
InChI Key:
HRYDKWQESARUIH-UHFFFAOYSA-N
SMILES:
NCCCCCCNC(=O)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.143g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
265.313g/mol
Monoisotopic Mass:
265.143g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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