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Home > Sulfanilamide > 918812-51-8
918812-51-8 | Benzenesulfonamide, 2-cyano-N-(1,1-dimethylethyl)-N-methyl-
CAS No: 918812-51-8 Catalog No: AG006BUB MDL No:
Product Description
Catalog Number:
AG006BUB
Chemical Name:
Benzenesulfonamide, 2-cyano-N-(1,1-dimethylethyl)-N-methyl-
CAS Number:
918812-51-8
Molecular Formula:
C12H16N2O2S
Molecular Weight:
252.3326
IUPAC Name:
N-tert-butyl-2-cyano-N-methylbenzenesulfonamide
InChI:
InChI=1S/C12H16N2O2S/c1-12(2,3)14(4)17(15,16)11-8-6-5-7-10(11)9-13/h5-8H,1-4H3
InChI Key:
MZTLDBCVPLCXKW-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1S(=O)(=O)N(C(C)(C)C)C
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.093g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.332g/mol
Monoisotopic Mass:
252.093g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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