1H-Benzimidazolium, 2-[3-[1,3-dihydro-1-methyl-3-(4-sulfobutyl)-5-(trifluoromethyl)-2H-benzimidazol-
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Product Description
Product
1H-Benzimidazolium, 2-[3-[1,3-dihydro-1-methyl-3-(4-sulfobutyl)-5-(trifluoromethyl)-2H-benzimidazol-
CAS
63834-91-3
Formula
C29H31F6N4NaO6S2; C29H32F6N4O6S2.Na
Typical Product Specifications
Molecular weight
732.69
EINECS
264-508-6
SMILES
N1([C@@H](N(c2ccc(cc12)C(F)(F)F)C)\C=C/C=C1\N(c2c(N1C)ccc(C(F)(F)F)c2)CCCCS(=O)(=O)O)CCCCS(=O)([O-])=O.[Na+]
InChI
PJDKKAHKLXNQMA-QQZSASQOSA-M
InChIKey
1S/C29H34F6N4O6S2.Na/c1-36-22-12-10-20(28(30,31)32)18-24(22)38(14-3-5-16-46(40,41)42)26(36)8-7-9-27-37(2)23-13-11-21(29(33,34)35)19-25(23)39(27)15-4-6-17-47(43,44)45;/h7-13,18-19,26H,3-6,14-17H2,1-2H3,(H,40,41,42)(H,43,44,45);/q;+1/p-1/b8-7?,27-9-;
Class
1H-Benzimidazolium, 2-[3-[1,3-dihydro-1-methyl-3-(4-sulfobutyl)-5-(trifluoromethyl)-2H-benzimidazol-
Product Description
Product
1H-Benzimidazolium, 2-[3-[1,3-dihydro-1-methyl-3-(4-sulfobutyl)-5-(trifluoromethyl)-2H-benzimidazol-
CAS
63834-91-3
Formula
C29H31F6N4NaO6S2; C29H32F6N4O6S2.Na
Typical Product Specifications
Molecular weight
732.69
EINECS
264-508-6
SMILES
N1([C@@H](N(c2ccc(cc12)C(F)(F)F)C)\C=C/C=C1\N(c2c(N1C)ccc(C(F)(F)F)c2)CCCCS(=O)(=O)O)CCCCS(=O)([O-])=O.[Na+]
InChI
PJDKKAHKLXNQMA-QQZSASQOSA-M
InChIKey
1S/C29H34F6N4O6S2.Na/c1-36-22-12-10-20(28(30,31)32)18-24(22)38(14-3-5-16-46(40,41)42)26(36)8-7-9-27-37(2)23-13-11-21(29(33,34)35)19-25(23)39(27)15-4-6-17-47(43,44)45;/h7-13,18-19,26H,3-6,14-17H2,1-2H3,(H,40,41,42)(H,43,44,45);/q;+1/p-1/b8-7?,27-9-;
Class
