(E)-5-Decenyl acetate
Basic information
- CAS
38421-90-8- Standard SMILES
CCCC/C=C/CCCCOC(C)=O- InChIKey
VTUFOIHYMMMNOM-VOTSOKGWSA-N- Molecular formula
- C12H22O2
- Average molar mass
- 198.3 g/mol
- Monoisotopic mass
- 198.16197994
Overview
5E-Decenyl acetate is a carboxylic ester.
Names & identifiers
- Preferred name
- (E)-5-Decenyl acetate
- IUPAC
- [(E)-dec-5-enyl] acetate
- English name
- (E)-5-Decen-1-yl acetate
- Molecular formula
- C12H22O2
- Molecular weight
- 198.3
Names & synonyms
38421-90-8(E)-5-Decenyl acetate5-Decen-1-ol, acetate, (5E)-5-Decenyl acetate7NJ786556ERefChem:535252253-923-8(E)-5-Decen-1-yl acetate(E)-5-Decen-1-YLacetate(E)-5-Decen-1-ol acetatetrans-5-Decenyl acetate5E-Decenyl acetate
Show more names
5E-10Ac(e)-5-decenyl(5E)-Decenyl acetate(e)-5-decenylacetate5-(E)-Decenyl acetatedec-5-en-1-yl acetatetrans-5-decenylacetate(E)-dec-5-enyl acetate
[(E)-dec-5-enyl] acetate5-Decen-1-ol, acetate, (E)-(5E)-5-Decenyl acetateE-5-Decen-1-yl acetateEINECS 253-923-8(Z)-dec-5-en-1-yl acetate5-Decenyl acetate, (5E)-AI3-35123
Database identifiers
- CAS
38421-90-8- PubChem CID
- 5363095
- DTXSID
DTXSID0035295- ChEBI
CHEBI:179186- UNII
- 7NJ786556E
- EC Number
- 253-923-8
- Nikkaji
- J118.252H、J689K
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 162
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Fatty esters [FA07] -> Short fatty esters [FA0710]
Pesticides
Attractants
Active substance -> EU Pesticides database: Approved
Physicochemical properties
- Boiling point
- 210.5 · 210.5±0.0℃ (760 Torr)
- Density
- 0.886 · 0.886±0.06 g/cm3 (20 ºC 760 Torr)
- refractive index
- 1.4393 · 1.4393 (19℃)
- Flash point
- 62.2 · 62.2±0.0℃
- storage temp.
- -20 °C · -20°C
- solubility
- Chloroform (Slightly), Ethyl Acetate (Slightly)
- form
- Oil
- color
- Clear Yellow
- LogP
- 4.51 · 4.510 (est)
- FDA UNII
- 7 NJ786556E · 7NJ786556E
- EPA Substance Registry System
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 152 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Commission Regulation (EC) No 2229/2004
Reg. (EU) 2008/127, Reg. (EU) 2017/195, Reg. (EU) 2021/745, Reg. (EU) 2022/1251, Reg. (EU) No 540/2011, Reg. (EU) No 918/2014, Reg. (EU)2020/1160
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- tsca
- TSCA listed
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H411-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Uses & manufacturing
General Manufacturing Information5-Decen-1-ol, 1-acetate, (5E)-: ACTIVE
Applications
Uses(E)-5-Decen-1-ol Acetate is an insect sex-attractant pheromone component and is a major component in the Peach Twig Borer pheromone.
Additional notes
DefinitionChEBI: 5E-Decenyl acetate is a carboxylic ester.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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