Basic information
- CAS
20711-10-8- Standard SMILES
CC/C=C\CCCCCCCCCCOC(C)=O- InChIKey
YJINQJFQLQIYHX-PLNGDYQASA-N- Molecular formula
- C16H30O2
- Average molar mass
- 254.41 g/mol
- Monoisotopic mass
- 254.2245802
Names & identifiers
- Preferred name
- 11-Tetradecenyl acetate, (11Z)-
- IUPAC
- [(Z)-tetradec-11-enyl] acetate
- English name
- (Z)-11-TETRADECEN-1-YL ACETATE
- Molecular formula
- C16H30O2
- Molecular weight
- 254.41
Names & synonyms
Show more names
Database identifiers
- CAS
20711-10-8- PubChem CID
- 5367692
- DTXSID
DTXSID3035266- ChEMBL
CHEMBL3181839- ChEBI
CHEBI:179801- UNII
- U0U163294D
- EC Number
- 243-982-8
- Nikkaji
- J664E
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 13
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 209
Experimental & physicochemical properties
Kovats Retention Index
1788;1800.9;1783.7
1812;1743
2137;2154
Physicochemical properties
- Melting point
- 25 ℃ · <25℃
- Boiling point
- 316.2 · 316.2±11.0℃ (760 torr)
- Density
- 0.878 · 0.878±0.06 g/cm3 (20 ºC 760 Torr)
- refractive index
- 1.4515 · 1.4515 (20℃)
- Flash point
- 87.2 · 87.2±17.6℃
- storage temp.
- 2 · 2-8°C
- solubility
- Chloroform, Methanol (Sparingly)
- form
- Oil
- color
- Colourless
- InChI
- InChI=1S/C16H30O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-16(2)17/h4-5H,3,6-15H2,1-2H3/b5-4-
- InChIKey
- YJINQJFQLQIYHX-PLNGDYQASA-N
- SMILES
- C(OC(=O)C)CCCCCCCCC/C=C\CC
- LogP
- 6.49 · 6.490 (est)
- CAS DataBase Reference
- 20711 · 20711-10-8
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 0 U163294D · U0U163294D
- EPA Substance Registry System
- -11 · (Z)-11-Tetradecen-1-ol acetate (20711-10-8)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- TSCA
- TSCA listed
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (53.4%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (53.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (53.4%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H411 (38.4%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
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 73 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Regulatory Information
Commission Regulation (EC) No 2229/2004
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
Regulatory information
Regulatory Information
Commission Regulation (EC) No 2229/2004
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
Safety data
- tsca
- TSCA listed
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H335-H315-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Uses & manufacturing
Applications
Uses(Z)-11-Tetradecenyl Acetate is a sex pheremone component that can be found in various insect specie, such as O. nubilalis and Asian and European corn borers.
Upstream & downstream products
Downstream products
Suppliers53 total
Additional notes
DefinitionChEBI: 11Z-Tetradecenyl acetate is a carboxylic ester.
Related reactions
Compound notes
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