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Home > Nitro Compounds > 23530-47-4
23530-47-4 | Benzenesulfonamide, 4-nitro-N-propyl-
CAS No: 23530-47-4 Catalog No: AG002NLH MDL No:MFCD00514616
Product Description
Catalog Number:
AG002NLH
Chemical Name:
Benzenesulfonamide, 4-nitro-N-propyl-
CAS Number:
23530-47-4
Molecular Formula:
C9H12N2O4S
Molecular Weight:
244.2676
MDL Number:
MFCD00514616
IUPAC Name:
4-nitro-N-propylbenzenesulfonamide
InChI:
InChI=1S/C9H12N2O4S/c1-2-7-10-16(14,15)9-5-3-8(4-6-9)11(12)13/h3-6,10H,2,7H2,1H3
InChI Key:
WPVVWLXGHXMNMA-UHFFFAOYSA-N
SMILES:
CCCNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
NSC Number:
30345
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.052g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.265g/mol
Monoisotopic Mass:
244.052g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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