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68039-23-6

68039-23-6 | 4,5-dihydro-1-(2-hydroxyethyl)-3-(2-hydroxy-3-sulphonatopropyl)-2-undecyl-1H-imidazolium, monosodium salt

CAS No: 68039-23-6 Catalog No: AG00FOUM MDL No:

Product Description

Catalog Number:
AG00FOUM
Chemical Name:
4,5-dihydro-1-(2-hydroxyethyl)-3-(2-hydroxy-3-sulphonatopropyl)-2-undecyl-1H-imidazolium, monosodium salt
CAS Number:
68039-23-6
IUPAC Name:
sodium;3-[3-(2-hydroxyethyl)-2-undecyl-4,5-dihydroimidazol-3-ium-1-yl]-2-oxidopropane-1-sulfonate
InChI:
InChI=1S/C19H38N2O5S.Na/c1-2-3-4-5-6-7-8-9-10-11-19-20(14-15-22)12-13-21(19)16-18(23)17-27(24,25)26;/h18,22H,2-17H2,1H3,(H,24,25,26);/q;+1/p-1
InChI Key:
HUNDOOLFNARUBZ-UHFFFAOYSA-M
EC Number:
268-242-1

Properties

Complexity:
517  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
428.232g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
428.564g/mol
Monoisotopic Mass:
428.232g/mol
Rotatable Bond Count:
15  
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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