Basic information
- Standard SMILES
CCCCC/C=C\C/C=C\CCCCCCCC(=O)Cl- InChIKey
FBWMYSQUTZRHAT-HZJYTTRNSA-N- Molecular formula
- C18H31ClO
- Average molar mass
- 298.9 g/mol
- Monoisotopic mass
- 298.20634329
Names & identifiers
- Preferred name
- Linoleoyl chloride
- IUPAC
- (9Z,12Z)-octadeca-9,12-dienoyl chloride
Names & synonyms
Linoleoyl chlorideLinoleic acid chloride7459-33-8Lineoleoyl chloride9,12-Octadecadienoyl chloride, (Z,Z)-R0E0WI3SP3EINECS 231-233-8UNII-R0E0WI3SP3NSC 162219DTXSID30880877NSC-162219RefChem:153558
Show more names
DTXCID201022225231-233-8FBWMYSQUTZRHAT-HZJYTTRNSA-N(9Z,12Z)-Octadeca-9,12-dienoyl chlorideLINOLEOYLCHLORIDEMFCD00151403C18H31ClOlinolic acid chloride
Database identifiers
- CAS
7459-33-8- PubChem CID
- 9817754
- DTXSID
DTXSID30880877- UNII
- R0E0WI3SP3
- EC Number
- 231-233-8
- Nikkaji
- J149.776F
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 14
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 269
Safety & regulation
GHS classification
GHS Classification
Danger
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information9,12-Octadecadienoyl chloride, (9Z,12Z)-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Corr. 1B (100%)
Chemistry & industry
Uses & manufacturing
General Manufacturing Information9,12-Octadecadienoyl chloride, (9Z,12Z)-: INACTIVE
Related reactions
15 records
Linked notes
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