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101513-20-6 | Benzenamine, 4-[(4-aminophenyl)sulfonyl]-N,3-dimethyl-
CAS No: 101513-20-6 Catalog No: AG0004PB MDL No:
Product Description
Catalog Number:
AG0004PB
Chemical Name:
Benzenamine, 4-[(4-aminophenyl)sulfonyl]-N,3-dimethyl-
CAS Number:
101513-20-6
Molecular Formula:
C14H16N2O2S
Molecular Weight:
276.3540
IUPAC Name:
4-(4-aminophenyl)sulfonyl-N,3-dimethylaniline
InChI:
InChI=1S/C14H16N2O2S/c1-10-9-12(16-2)5-8-14(10)19(17,18)13-6-3-11(15)4-7-13/h3-9,16H,15H2,1-2H3
InChI Key:
JXEXDNIFJLJTEI-UHFFFAOYSA-N
SMILES:
CNc1ccc(c(c1)C)S(=O)(=O)c1ccc(cc1)N
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.093g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
276.354g/mol
Monoisotopic Mass:
276.093g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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