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Home > Sulfanilamide > 871563-17-6
871563-17-6 | N-(2-Hydroxymethyl-4,5-dimethoxy-phenyl)-4-methyl-benzenesulfonamide
CAS No: 871563-17-6 Catalog No: AG01F5AO MDL No:
Product Description
Catalog Number:
AG01F5AO
Chemical Name:
N-(2-Hydroxymethyl-4,5-dimethoxy-phenyl)-4-methyl-benzenesulfonamide
CAS Number:
871563-17-6
Molecular Formula:
C16H19NO5S
Molecular Weight:
337.3908
IUPAC Name:
N-[2-(hydroxymethyl)-4,5-dimethoxyphenyl]-4-methylbenzenesulfonamide
InChI:
InChI=1S/C16H19NO5S/c1-11-4-6-13(7-5-11)23(19,20)17-14-9-16(22-3)15(21-2)8-12(14)10-18/h4-9,17-18H,10H2,1-3H3
InChI Key:
ZEANMQGTAJNXPZ-UHFFFAOYSA-N
SMILES:
OCc1cc(OC)c(cc1NS(=O)(=O)c1ccc(cc1)C)OC
Properties
Complexity:
456
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.098g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
337.39g/mol
Monoisotopic Mass:
337.098g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
93.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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