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85077-82-3 | Benzenesulfonamide, 4-dodecyl-N,N-bis(2-hydroxyethyl)-
CAS No: 85077-82-3 Catalog No: AG004RQP MDL No:
Product Description
Catalog Number:
AG004RQP
Chemical Name:
Benzenesulfonamide, 4-dodecyl-N,N-bis(2-hydroxyethyl)-
CAS Number:
85077-82-3
Molecular Formula:
C22H39NO4S
Molecular Weight:
413.6144
IUPAC Name:
4-dodecyl-N,N-bis(2-hydroxyethyl)benzenesulfonamide
InChI:
InChI=1S/C22H39NO4S/c1-2-3-4-5-6-7-8-9-10-11-12-21-13-15-22(16-14-21)28(26,27)23(17-19-24)18-20-25/h13-16,24-25H,2-12,17-20H2,1H3
InChI Key:
MOKPZHYFFOBSGI-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)N(CCO)CCO
Properties
Complexity:
450
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
413.26g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
413.617g/mol
Monoisotopic Mass:
413.26g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
86.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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