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915372-72-4 | Benzenesulfonamide, N-(2-hydroxyphenyl)-4-methoxy-2,3,6-trimethyl-
CAS No: 915372-72-4 Catalog No: AG00697D MDL No:
Product Description
Catalog Number:
AG00697D
Chemical Name:
Benzenesulfonamide, N-(2-hydroxyphenyl)-4-methoxy-2,3,6-trimethyl-
CAS Number:
915372-72-4
Molecular Formula:
C16H19NO4S
Molecular Weight:
321.3914
IUPAC Name:
N-(2-hydroxyphenyl)-4-methoxy-2,3,6-trimethylbenzenesulfonamide
InChI:
InChI=1S/C16H19NO4S/c1-10-9-15(21-4)11(2)12(3)16(10)22(19,20)17-13-7-5-6-8-14(13)18/h5-9,17-18H,1-4H3
InChI Key:
ZJNBFMMEQOTYSN-UHFFFAOYSA-N
SMILES:
COc1cc(C)c(c(c1C)C)S(=O)(=O)Nc1ccccc1O
Properties
Complexity:
461
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.103g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
321.391g/mol
Monoisotopic Mass:
321.103g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
84A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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