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Home > Sulfanilamide > 90312-02-0
90312-02-0 | N-(2-Hydroxymethyl-phenyl)-4-methyl-benzenesulfonamide
CAS No: 90312-02-0 Catalog No: AG01F84F MDL No:
Product Description
Catalog Number:
AG01F84F
Chemical Name:
N-(2-Hydroxymethyl-phenyl)-4-methyl-benzenesulfonamide
CAS Number:
90312-02-0
Molecular Formula:
C14H15NO3S
Molecular Weight:
277.3388
IUPAC Name:
N-[2-(hydroxymethyl)phenyl]-4-methylbenzenesulfonamide
InChI:
InChI=1S/C14H15NO3S/c1-11-6-8-13(9-7-11)19(17,18)15-14-5-3-2-4-12(14)10-16/h2-9,15-16H,10H2,1H3
InChI Key:
VRPNCJQOSSNTOR-UHFFFAOYSA-N
SMILES:
OCc1ccccc1NS(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.077g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
277.338g/mol
Monoisotopic Mass:
277.077g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| N-(2-Formyl-phen-yl)-4-toluene-sulfonamide: a second monoclinic polymorph. | Acta crystallographica. Section E, Structure reports online 20120401 |
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