Tributyl aconitate structure

Tributyl aconitate

tributyl (Z)-prop-1-ene-1,2,3-tricarboxylate

Also Known As: Tributyl aconitate|Tributyl prop-1-ene-1,2,3-tricarboxylate|Tri-n-butyl aconitate|Aconitic acid, tributyl ester|Tributyl cis-aconitate|Tributyl aconitate [EP]|EINECS 231-468-6|cis-Aconitic acid tributyl ester|Tributyl propene-1,2,3-tricarboxylate|tributyl (Z)-prop-1-ene-1,2,3-tricarboxylate|Tributyl acetylcitrate impurity B|Acetyltributyl Citrate Impurity B|AI3-00999|1-Propene-1,2,3-tricarboxylic acid, tributyl ester|Tributyl acetylcitrate impurity B [EP]|TRIBUTYL ACONITATE [EP IMPURITY]|Tributyl Acetylcitrate EP Impurity B|TRIBUTYL ACONITATE (EP IMPURITY)|Tributylprop-1-ene-1,2,3-tricarboxylate|1,2,3-Propenetricarboxylic acid, tributyl ester|Tributyl Aconitate (Majority Trans Isomer)|1,2,3-tributyl prop-1-ene-1,2,3-tricarboxylate|TRIBUTYL ACETYLCITRATE IMPURITY B [EP IMPURITY]|Tributyl (1Z)-1-propene-1,2,3-tricarboxylate #|1-Propene-1,2,3-tricarboxylic acid tributyl ester|1-Propene-1,2,3-tricarboxylic acid, tris(N.-butyl ester)|cis-propene-1,2,3-tricarboxylic acid tributyl ester|TRIBUTYL ACETYLCITRATE IMPURITY B (EP IMPURITY)|(Z)-1-Propene-1,2,3-tricarboxylic acid tributyl ester

CAS: 79671-06-0
Molecular Formula C18H30O6
Molecular Weight 342.20422 g/mol
LogP 3.3328
Topological Polar Surface Area 78.9 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 13
Exact Mass 342.20422
Monoisotopic Mass 342.20422
Heavy Atoms 24
Complexity 413.73206

Chemical Identifiers

CAS Number 79671-06-0
SMILES CCCCOC(=O)C/C(=C/C(=O)OCCCC)/C(=O)OCCCC

Product Overview

Tributyl aconitate (CAS 79671-06-0), with molecular formula C18H30O6 and molecular weight 342.20422 g/mol. IUPAC: tributyl (Z)-prop-1-ene-1,2,3-tricarboxylate.

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