AC1NSTXT structure

AC1NSTXT

dimethyl (2E,6E,10E)-13-(benzenesulfonyl)-3,7,11-trimethyl-13-(2-methylprop-1-enyl)tetradeca-2,6,10-trienedioate

Also Known As: -3,7,11-Trimethyl-13- -13- -2,6,10-tetradecatrienedioicaciddimethylester|2,6,10-Tetradecatrienedioic acid, 3,7,11-trimethyl-13-(2-methyl-1-propenyl)-13-(phenylsulfonyl)-, dimethyl ester, (E,E,E)-|(2E,6E,10E)-3,7,11-Trimethyl-13-(2-methyl-1-propenyl)-13-(phenylsulfonyl)-2,6,10-tetradecatrienedioic acid dimethyl ester|1,14-dimethyl (2E,6E,10E)-13-(benzenesulfonyl)-3,7,11-trimethyl-13-(2-methylprop-1-en-1-yl)tetradeca-2,6,10-trienedioate|dimethyl (2E,6E,10E)-13-(benzenesulfonyl)-3,7,11-trimethyl-13-(2-methylprop-1-enyl)tetradeca-2,6,10-trienedioate|Dimethyl (2E,6E,10E)-3,7,11-trimethyl-13-(2-methyl-1-propenyl)-13-(phenylsulfonyl)-2,6,10-tetradecatrienedioate #

CAS: 57683-69-9
Molecular Formula C29H40O6S
Molecular Weight 516.2546 g/mol
LogP 6.3007
Topological Polar Surface Area 86.74 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 13
Exact Mass 516.2546
Monoisotopic Mass 516.2546
Heavy Atoms 36
Complexity 1119.5554

Chemical Identifiers

CAS Number 57683-69-9
SMILES CC(=CC(C/C(=C/CC/C(=C/CC/C(=C/C(=O)OC)/C)/C)/C)(C(=O)OC)S(=O)(=O)C1=CC=CC=C1)C

Product Overview

AC1NSTXT (CAS 57683-69-9), with molecular formula C29H40O6S and molecular weight 516.2546 g/mol. IUPAC: dimethyl (2E,6E,10E)-13-(benzenesulfonyl)-3,7,11-trimethyl-13-(2-methylprop-1-enyl)tetradeca-2,6,10-trienedioate.

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