Basic information
- CAS
224948-75-8- Standard SMILES
CCCCC/C=C\C/C=C\CCCCCCCCO- InChIKey
JXNPEDYJTDQORS-HZJYTTRNSA-N- Molecular formula
- C18H34O
- Average molar mass
- 266.5 g/mol
- Monoisotopic mass
- 266.2609657
Names & identifiers
- Preferred name
- Linoleyl alcohol
- IUPAC
- (9Z,12Z)-octadeca-9,12-dien-1-ol
- English name
- CIS,CIS-9,12-OCTADECADIENOL
- Molecular formula
- C18H34O
- Molecular weight
- 266.46
Names & synonyms
(9Z,12Z)-Octadeca-9,12-dien-1-ol506-43-4Linoleyl alcoholcis,cis-9,12-Octadecadien-1-olcis,cis-Octadeca-9,12-dien-1-olP4OX1289YW(9Z,12Z)-octadecadien-1-ol9-cis,12-cis-octadecadien-1-ol(Z,Z)-octadeca-9,12-dien-1-olCHEBI:73534RefChem:799237208-038-1
Show more names
Linolyl alcohol9,12-Octadecadien-1-ol, (9Z,12Z)-9-12 LINOLEYLOctadecadienol9-12 LINOLEYL ALCOHOLLinoleyl Alcohol(C18:2)
9,12-Octadecadien-1-olCIS,CIS-9,12-OCTADECADIENOLC18H34O(Z,Z)-9,12-Octadecadien-1-ol9,12-Octadecadien-1-ol, (Z,Z)-MFCD00056667BP-30113O0225
Database identifiers
- CAS
224948-75-8、506-43-4- PubChem CID
- 5365682
- DTXSID
DTXSID50881240- ChEBI
CHEBI:73534- UNII
- P4OX1289YW
- EC Number
- 208-038-1
- Nikkaji
- J12.227K
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 14
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 206
Experimental & physicochemical properties
Kovats Retention Index2052
Physicochemical properties
- Melting point
- -5 · -5--2 °C
- Boiling point
- 149 °C · 149 °C / 1mmHg
- Density
- 0 · 0,86 g/cm3
- refractive index
- 1.467 to · 1.4670 to 1.4710
- Flash point
- 124 ℃ · 124℃
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- Chloroform (Sparingly), Methanol (Slightly)
- form
- Oil
- pka
- 15.2 · 15.20±0.10(Predicted)
- color
- Colourless
- Stability
- Light Sensitive
- Major Application
- pharmaceutical small molecule
- InChI
- InChI=1S/C18H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h6-7,9-10,19H,2-5,8,11-18H2,1H3/b7-6-,10-9-
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
This chemical does not meet GHS hazard criteria for 100% (116 of 116) of all reports.
Not Classified；Reported as not meeting GHS hazard criteria by 116 of 116 companies. For more detailed information, please visit ECHA C&L website.
Aggregated GHS information provided per 116 reports by companies from 2 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 116 of 116 reports by companies.；There are 0 notifications provided by 0 of 116 reports by companies with hazard statement code(s).；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 InformationChemical: 9,12-Octadecadien-1-ol, (Z,Z)-
Other Safety InformationIMAP assessments - 9,12-Octadecadien-1-ol, (Z,Z)-: Human health tier I assessment
Hazard Classes and CategoriesNot Classified
Regulatory information
Regulatory InformationChemical: 9,12-Octadecadien-1-ol, (Z,Z)-
Safety data
- wgk
- nwg
- tsca
- TSCA listed
- hs_code
- 2905299000
Chemistry & industry
Pharmacology
Metabolism/MetabolitesLinoleyl alcohol has known human metabolites that include linoleyl O-glucuronide.
Uses & manufacturing
General Manufacturing Information9,12-Octadecadien-1-ol, (9Z,12Z)-: ACTIVE
Applications
Uses(9Z,12Z)-9,12-Octadecadien-1-ol is a linoleyl acid derivative and building block used in the synthesis of lipid-based unsymmetrical O,O-dialkylphosphites. (9Z,12Z)-9,12-Octadecadien-1-ol has been synthesized by transfer hydrogenation using a ruthenium-based catalyst from its parent fatty acid.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
衢州润东化工有限公司
Related reactions
19 records
Compound notes
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