Basic information
- CAS
22882-95-7- Standard SMILES
CCCCCC=CCC=CCCCCCCCC(=O)OC(C)C- InChIKey
XEIOPEQGDSYOIH-UHFFFAOYSA-N- Molecular formula
- C21H38O2
- Average molar mass
- 322.5 g/mol
- Monoisotopic mass
- 322.28718045
Names & identifiers
- Preferred name
- 9,12-Octadecadienoic acid (9Z,12Z)-, 1-methylethyl ester
- IUPAC
- propan-2-yl octadeca-9,12-dienoate
- English name
- Isopropyl linoleate
- Molecular formula
- C21H38O2
- Molecular weight
- 322.53
Names & synonyms
9,12-Octadecadienoic acid (9Z,12Z)-, 1-methylethyl esterDTXSID4066834RefChem:548841DTXCID0036766propan-2-yl octadeca-9,12-dienoateisopropyl octadeca-9,12-dienoateSCHEMBL278600529,12-octadecadienoic acid 1-methylethyl esterceraphyliplBrn 1880297Ceraphyl IPLEinecs 245-289-6
Show more names
isopropyllinolateIsopropyl linoleateIsopropylLinoleate>LINOLEIC ACID ISOPROPYL ESTERIsopropyl 9,12-octadecadienoate1-methylethyl-9,12-octadecadienoate
Database identifiers
- CAS
22882-95-7- PubChem CID
- 89882
- DTXSID
DTXSID4066834
Properties
Computed structural properties
- XLogP
- 7.7
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 16
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 316
Physicochemical properties
- Boiling point
- 179 °C · 179 °C / 2.5mmHg
- Density
- 0.87 · 0.87
- refractive index
- 1.452 to · 1.4520 to 1.4560
- Flash point
- 191 °C · 191 °C
- form
- clear liquid
- color
- Colorless to Light yellow
- Cosmetics Ingredients Functions
- BINDINGSKIN CONDITIONING - EMOLLIENTSKIN CONDITIONING
- Cosmetic Ingredient Review (CIR)
- ISOPROPYL LINOLEATE (22882-95-7)
- LogP
- 8.478 · 8.478 (est)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 4 MW1E9AT4H · 4MW1E9AT4H
- EPA Substance Registry System
- 9 · 9,12-Octadecadienoic acid (9Z,12Z)-, 1-methylethyl ester (22882-95-7)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory Information9,12-Octadecadienoic acid (9Z,12Z)-, 1-methylethyl ester: Does not have an individual approval but may be used under an appropriate group standard
Safety data
- tsca
- TSCA listed
- rtecs
- RG0180210
- hs_code
- 2916.19.5000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing Information9,12-Octadecadienoic acid (9Z,12Z)-, 1-methylethyl ester: INACTIVE
Applications
UsesIsopropyl Linoleate is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
Suppliers32 total
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Hebei Zhuanglai Chemical Trading Co Ltd+86-16264648883 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
广东大小化工有限公司171603 18666171603 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
江苏艾康生物医药研发有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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