Tetradeca-3,8,11-trienyl acetate, (3E,8Z,11Z)-

HCID 9992319CAS 163041-94-9
Substructure searchFind similar structures

Basic information

Standard SMILES
CC/C=C\C/C=C\CCC/C=C/CCOC(C)=O
InChIKey
HWPJPNQEVWTZSJ-XBZOLNABSA-N
Molecular formula
C16H26O2
Average molar mass
250.38 g/mol
Monoisotopic mass
250.19328007

Overview

3E,8Z,11Z-Tetradecatrienyl acetate is a carboxylic ester.

Names & identifiers

Preferred name
Tetradeca-3,8,11-trienyl acetate, (3E,8Z,11Z)-
IUPAC
[(3E,8Z,11Z)-tetradeca-3,8,11-trienyl] acetate
English name
E3,Z8,Z11-Tetradecatriene acetate
Molecular formula
C16H26O2
Molecular weight
250.38

Names & synonyms

163041-94-9(3E,8Z,11Z)-Tetradeca-3,8,11-trienyl acetate(3E,8Z,11Z)-3,8,11-tetradecatrien-1-yl acetateTetradeca-3,8,11-trienyl acetate, (3E,8Z,11Z)-6CQR9SPA873,8,11-Tetradecatrien-1-ol, 1-acetate, (3E,8Z,11Z)-(E,Z,Z)-3,8,11-Tetradecatrien-1-ol acetateDTXSID50700624RefChem:896851DTXCID101285018682-695-6(3E,8Z,11Z)-Tetradeca-3,8,11-trien-1-yl acetate
Show more names
(E,Z,Z)-3,8,11-Tetradecatrienyl acetateE3Z8Z11-14Ac3E8Z11Z-14AcTuta absoluta Pheromone blendetradeca-1,3,5-trienylacetateTuta Absoluta PheroMone (Major)tetradeca-1,3,5-trienyl acetateE3,Z8,Z11-Tetradecatriene acetate
[(3E,8Z,11Z)-tetradeca-3,8,11-trienyl] Acetate3E,8Z,11Z-Tetradecatrienyl acetateMFCD22581574(3E,8Z,11Z)-3,8,11-Tetradecatrienyl acetate(3E,8Z,11Z)-Tetradeca-3,8,11-trienyl Acetate (>75%)UNII-6CQR9SPA87(3E,8Z,11Z)-3,8,11-Tetradecatrien-1-yl Acetate; (E,Z,Z)-3,8,11-Tetradecatrienyl Acetate;3E, 8Z, 11Z-Tetradecatrienyl acetate

Database identifiers

CAS
163041-94-9
PubChem CID
9992319
DTXSID
DTXSID50700624
ChEBI
CHEBI:180360
UNII
6CQR9SPA87
EC Number
682-695-6
Nikkaji
J699.698A

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
11
Heavy atoms
18

Experimental & physicochemical properties

LipidsFatty Acyls [FA] -> Fatty esters [FA07] -> Short fatty esters [FA0710]

Physicochemical properties

Boiling point
333.6 · 333.6±31.0 °C(Predicted)
Density
0.903 · 0.903±0.06 g/cm3(Predicted)
storage temp.
Amber Vial, Refrigerator
solubility
Chloroform (Slightly), Methanol (Slightly)
form
Oil
color
Colourless

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P280, P302+P352, P321, P332+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 2 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H332-H335
Precautionary statements
P261-P280-P305+P351+P338

Chemistry & industry

Applications

DescriptionE3,Z8,Z11-Tetradecatriene acetate is a colorless oil liquid, soluble in hydrocarbons, alcohols, ketones, esters. Insoluble in water. It can be isolated from the tomato pest Silica moth.

Uses(3E,8Z,11Z)-Tetradeca-3,8,11-trienyl Acetate is a compound found in the pheromones. It is a major sex pheromone component of the tomato pest.

Suppliers50 total

郑州阿尔法化工有限公司+86-18530059196 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]

Additional notes

DefinitionChEBI: 3E,8Z,11Z-Tetradecatrienyl acetate is a carboxylic ester.

Related reactions

1 records
New reaction record

Linked notes

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