1,2-Benzenedicarboxylic acid, mixed esters with isodecanol, isononanol, 3-methyl-1,5-pentanediol and
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Product Description
Product
1,2-Benzenedicarboxylic acid, mixed esters with isodecanol, isononanol, 3-methyl-1,5-pentanediol and
CAS
93762-47-1
Typical Product Specifications
EINECS
297-761-6
Molecular weight
801.58
EINECS
251-605-3
SMILES
C(N1c2cc(c(cc2N(\C1=C/C=C/c1n(c2c([n+]1CC)cc(Cl)c(C(F)(F)F)c2)CCCCS(=O)(=O)[O-])CC)Cl)C(F)(F)F)CCCS(=O)(=O)[O-].[Na+]
InChI
RYNJTCIHLVYZOG-UHFFFAOYSA-M
InChIKey
1S/C31H34Cl2F6N4O6S2.Na/c1-3-40-26-18-22(32)20(30(34,35)36)16-24(26)42(12-5-7-14-50(44,45)46)28(40)10-9-11-29-41(4-2)27-19-23(33)21(31(37,38)39)17-25(27)43(29)13-6-8-15-51(47,48)49;/h9-11,16-19H,3-8,12-15H2,1-2H3,(H-,44,45,46,47,48,49);/q;+1/p-1
Class
1,2-Benzenedicarboxylic acid, mixed esters with isodecanol, isononanol, 3-methyl-1,5-pentanediol and
Product Description
Product
1,2-Benzenedicarboxylic acid, mixed esters with isodecanol, isononanol, 3-methyl-1,5-pentanediol and
CAS
93762-47-1
Typical Product Specifications
EINECS
297-761-6
Molecular weight
801.58
EINECS
251-605-3
SMILES
C(N1c2cc(c(cc2N(\C1=C/C=C/c1n(c2c([n+]1CC)cc(Cl)c(C(F)(F)F)c2)CCCCS(=O)(=O)[O-])CC)Cl)C(F)(F)F)CCCS(=O)(=O)[O-].[Na+]
InChI
RYNJTCIHLVYZOG-UHFFFAOYSA-M
InChIKey
1S/C31H34Cl2F6N4O6S2.Na/c1-3-40-26-18-22(32)20(30(34,35)36)16-24(26)42(12-5-7-14-50(44,45)46)28(40)10-9-11-29-41(4-2)27-19-23(33)21(31(37,38)39)17-25(27)43(29)13-6-8-15-51(47,48)49;/h9-11,16-19H,3-8,12-15H2,1-2H3,(H-,44,45,46,47,48,49);/q;+1/p-1
Class
