Basic information
- CAS
59044-29-0- Standard SMILES
CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)Cl- InChIKey
MRKXCQPDRPTZCG-PDBXOOCHSA-N- Molecular formula
- C18H29ClO
- Average molar mass
- 296.9 g/mol
- Monoisotopic mass
- 296.19069323
Names & identifiers
- Preferred name
- (9Z,12Z,15Z)-9,12,15-Octadecatrienoyl chloride
- IUPAC
- (9Z,12Z,15Z)-octadeca-9,12,15-trienoyl chloride
- English name
- LINOLENOYL CHLORIDE
- Molecular formula
- C18H29ClO
- Molecular weight
- 296.88
Names & synonyms
EINECS 261-572-79,12,15-Octadecatrienoyl chloride, (Z,Z,Z)-(9Z,12Z,15Z)-9,12,15-Octadecatrienoyl chlorideDTXSID501014655RefChem:69848DTXCID301437194261-572-79,12,15-Octadecatrienoyl chloride, (9Z,12Z,15Z)-linolenoyl chloride59044-29-0Linolenoylchloride(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl chloride
Show more names
CIS-LINOLENOYL CHLORIDELinolenoylchloridetech,70%Linolenoyl chloride,70%,tech.Linolenoyl chloride, tech., 70%15-octadecatrienoylchloride,(z,z,z)-12DELTA 9-12-15 CIS-OCTADECATRIENOYL CHLORIDE
alpha-linolenic acid chlorideSCHEMBL1971784HY-166219NS000570869(Z),12(Z),15(Z)-Octadecatrienoyl chloride
Database identifiers
- CAS
59044-29-0- PubChem CID
- 6436844
- DTXSID
DTXSID501014655- EC Number
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 13
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 303
Physicochemical properties
- Boiling point
- 382.9 · 382.9±21.0 °C(Predicted)
- Density
- 0.942 · 0.942±0.06 g/cm3(Predicted)
- refractive index
- 1.478 · 1.478-1.48
- CAS DataBase Reference
- 59044 · 59044-29-0
- EPA Substance Registry System
- 9 · 9,12,15-Octadecatrienoyl chloride, (9Z,12Z,15Z)- (59044-29-0)
- Hazard Codes
- C
- Risk Statements
- 34 · 34
- Safety Statements
- 45 · 45-36/37/39-26
- TSCA
- TSCA listed
- HS Code
- 29130000 · 29130000
Safety & regulation
Safety data
- tsca
- TSCA listed
- hs_code
- 29130000
- risk_code
- 34
- hazard_code
- C
- safety_code
- 45-36/37/39-26
Chemistry & industry
Uses & manufacturing
General Manufacturing Information9,12,15-Octadecatrienoyl chloride, (9Z,12Z,15Z)-: ACTIVE
Applications
UsesLinolenoyl Chloride is a reagent used in the synthesis of Quercetin (Q509500) fatty acid esters as antioxidants.
Suppliers6 total
宜昌众意泰贸易有限公司0717-6449896 13886658719 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
山东西亚化学有限公司4009903999 13395398332 · [email protected]
山东天铭生物科技发展有限责任公司400-9019001 400-901-9001
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
1 records
Compound notes
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