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Home > Sulfanilamide > 97094-66-1
97094-66-1 | 2-(4-METHYLPHENYL)ETHANE-1-SULFONAMIDE
CAS No: 97094-66-1 Catalog No: AG01B35X MDL No:MFCD18426155
Product Description
Catalog Number:
AG01B35X
Chemical Name:
2-(4-METHYLPHENYL)ETHANE-1-SULFONAMIDE
CAS Number:
97094-66-1
Molecular Formula:
C9H13NO2S
Molecular Weight:
199.2700
MDL Number:
MFCD18426155
IUPAC Name:
2-(4-methylphenyl)ethanesulfonamide
InChI:
InChI=1S/C9H13NO2S/c1-8-2-4-9(5-3-8)6-7-13(10,11)12/h2-5H,6-7H2,1H3,(H2,10,11,12)
InChI Key:
GIAHBOGFOFDTAM-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)CCS(=O)(=O)N
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.268g/mol
Monoisotopic Mass:
199.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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