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Home > Sulfanilamide > 126826-61-7
126826-61-7 | Benzenesulfonamide, N-(hexahydro-1-methyl-2H-azepin-2-ylidene)-4-methyl-
CAS No: 126826-61-7 Catalog No: AG000TAH MDL No:
Product Description
Catalog Number:
AG000TAH
Chemical Name:
Benzenesulfonamide, N-(hexahydro-1-methyl-2H-azepin-2-ylidene)-4-methyl-
CAS Number:
126826-61-7
Molecular Formula:
C14H20N2O2S
Molecular Weight:
280.3858
IUPAC Name:
4-methyl-N-(1-methylazepan-2-ylidene)benzenesulfonamide
InChI:
InChI=1S/C14H20N2O2S/c1-12-7-9-13(10-8-12)19(17,18)15-14-6-4-3-5-11-16(14)2/h7-10H,3-6,11H2,1-2H3
InChI Key:
OZQXJGSVJRTSGW-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)N=C1CCCCCN1C
Properties
Complexity:
417
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.125g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.386g/mol
Monoisotopic Mass:
280.125g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.3
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