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83846-81-5 | Benzenesulfonamide,N,N-bis(2-hydroxypropyl)-4-methyl-
CAS No: 83846-81-5 Catalog No: AG0054T9 MDL No:
Product Description
Catalog Number:
AG0054T9
Chemical Name:
Benzenesulfonamide,N,N-bis(2-hydroxypropyl)-4-methyl-
CAS Number:
83846-81-5
Molecular Formula:
C13H21NO4S
Molecular Weight:
287.3751
IUPAC Name:
N,N-bis(2-hydroxypropyl)-4-methylbenzenesulfonamide
InChI:
InChI=1S/C13H21NO4S/c1-10-4-6-13(7-5-10)19(17,18)14(8-11(2)15)9-12(3)16/h4-7,11-12,15-16H,8-9H2,1-3H3
InChI Key:
BQXVKQIHSJDIIZ-UHFFFAOYSA-N
SMILES:
CC(CN(S(=O)(=O)c1ccc(cc1)C)CC(O)C)O
EC Number:
281-060-7
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.119g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
287.374g/mol
Monoisotopic Mass:
287.119g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
86.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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