2,4,6-Heptatrienoic acid, methyl ester structure

2,4,6-Heptatrienoic acid, methyl ester

methyl (2E,4E)-hepta-2,4,6-trienoate

Also Known As: methyl 2,4,6-heptatrienoate|methyl hepta-2,4,6-trienoate|2,4,6-Heptatrienoic acid methyl ester|2,4,6-Heptatrienoic acid, methyl ester|Methyl (2E,4E)-2,4,6-heptatrienoate|methyl (2E,4E)-hepta-2,4,6-trienoate|Methyl (2E,4E)-2,4,6-heptatrienoate #

CAS: 55833-81-3
Molecular Formula C8H10O2
Molecular Weight 138.06808 g/mol
LogP 1.4578
Topological Polar Surface Area 26.3 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 3
Exact Mass 138.06808
Monoisotopic Mass 138.06808
Heavy Atoms 10
Complexity 166.0964

Chemical Identifiers

CAS Number 55833-81-3
SMILES COC(=O)/C=C/C=C/C=C

Product Overview

2,4,6-Heptatrienoic acid, methyl ester (CAS 55833-81-3), with molecular formula C8H10O2 and molecular weight 138.06808 g/mol. IUPAC: methyl (2E,4E)-hepta-2,4,6-trienoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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