RefChem:79696

disodium;4-heptadecyl-1-[(3-sulfonatophenyl)methyl]benzimidazole-2-sulfonate

Also Known As: Disodium 2-heptadecyl-1-((3-sulphonatophenyl)methyl)-1H-benzimidazolesulphonate|1H-Benzimidazolesulfonic acid, 2-heptadecyl-1-((3-sulfophenyl)methyl)-, disodium salt|1H-Benzimidazolesulfonic acid, 2-heptadecyl-1-((3-sulfophenyl)methyl)-, sodium salt (1:2)|1H-Benzimidazolesulfonic acid, 2-heptadecyl-1-[(3-sulfophenyl)methyl]-, disodium salt|1H-Benzimidazolesulfonic acid, 2-heptadecyl-1-[(3-sulfophenyl)methyl]-, sodium salt (1:2)|Disodium 2-heptadecyl-1-[(3-sulphonatophenyl)methyl]-1H-benzimidazolesulphonate|disodium 4-heptadecyl-1-[(3-sulfonatophenyl)methyl]benzimidazole-2-sulfonate

Molecular Formula	C31H44N2Na2O6S2
Molecular Weight	650.2436 g/mol
LogP	1.3147
Topological Polar Surface Area	149.0 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	18
Exact Mass	650.2436
Monoisotopic Mass	650.2436
Heavy Atoms	43
Complexity	907.0

Chemical Identifiers

CAS Number	68228-07-9
SMILES	CCCCCCCCCCCCCCCCCC1=C2C(=CC=C1)N(C(=N2)S(=O)(=O)[O-])CC3=CC(=CC=C3)S(=O)(=O)[O-].[Na+].[Na+]
InChIKey	AMCWVAKIUQXBRL-UHFFFAOYSA-L