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Home > Nitro Compounds > 64732-67-8
64732-67-8 | Benzenesulfonamide, N-dodecyl-4-nitro-N-[(4-nitrophenyl)sulfonyl]-
CAS No: 64732-67-8 Catalog No: AG00H7U3 MDL No:
Product Description
Catalog Number:
AG00H7U3
Chemical Name:
Benzenesulfonamide, N-dodecyl-4-nitro-N-[(4-nitrophenyl)sulfonyl]-
CAS Number:
64732-67-8
Molecular Formula:
C24H33N3O8S2
Molecular Weight:
555.6641
IUPAC Name:
N-dodecyl-4-nitro-N-(4-nitrophenyl)sulfonylbenzenesulfonamide
InChI:
InChI=1S/C24H33N3O8S2/c1-2-3-4-5-6-7-8-9-10-11-20-25(36(32,33)23-16-12-21(13-17-23)26(28)29)37(34,35)24-18-14-22(15-19-24)27(30)31/h12-19H,2-11,20H2,1H3
InChI Key:
BBQRYSGDLQIHQG-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCN(S(=O)(=O)c1ccc(cc1)[N+](=O)[O-])S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
840
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
555.171g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
555.661g/mol
Monoisotopic Mass:
555.171g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
180A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4
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