Methyl ricinelaidate
Basic information
- CAS
7706-01-6- Standard SMILES
CCCCCC[C@@H](O)C/C=C/CCCCCCCC(=O)OC- InChIKey
XKGDWZQXVZSXAO-LVMGUKCRSA-N- Molecular formula
- C19H36O3
- Average molar mass
- 312.5 g/mol
- Monoisotopic mass
- 312.26644501
Names & identifiers
- Preferred name
- Methyl ricinelaidate
- IUPAC
- methyl (E,12R)-12-hydroxyoctadec-9-enoate
- English name
- Methyl ricinelaidate
- Molecular formula
- C19H36O3
- Molecular weight
- 312.49
Names & synonyms
Methyl ricinelaidate7706-01-6Trans-methyl ricinelaidateMethyl (R,E)-12-hydroxyoctadec-9-enoate(R,Z)-Methyl 12-hydroxyoctadec-9-enoatemethyl (E,12R)-12-hydroxyoctadec-9-enoateorb2944064SCHEMBL1594097TCL-00099AKOS024386336Methyl 9-trans-12-hydroxyoctadecenoateDB-220864
Show more names
RICINELAIC ACID METHYL ESTERRICINELAIDIC ACID METHYL ESTERMethyl Ricinelaidic Acid(C18:1T)12-HYDROXY C18:1 (9-TRANS) METHYL ESTERMETHYL TRANS-12-HYDROXY-9-OCTADECENOATE[R,E,(+)]-12-Hydroxy-9-octadecenoic acid methyl ester9-Octadecenoic acid, 12-hydroxy-, methyl ester, (9E,12R)-
HY-166977Methyl ricinelaidate, >=99% (GC), liquidST51037423Methyl (9e,12r)-12-hydroxy-9-octadecenoateH55363methyl (9E)(12R)-12-hydroxyoctadec-9-enoate
Database identifiers
- CAS
7706-01-6- PubChem CID
- 6507945
- EC Number
- 680-556-4
- Nikkaji
- J64.164B
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 16
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 274
Physicochemical properties
- Melting point
- 32 · 32-33 °C
- Boiling point
- 411.958 · 411.958±28.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.927 · 0.927±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- 20 °C · −20°C
- form
- liquid
- pka
- 15.099 · 15.099±0.20(predicted)
- Safety Statements
- 23 · 23-24/25
- WGK Germany
- 3 · 3
- F
- 10 · 10-23
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 ClassificationNot Classified
Hazard information
Hazard Classes and CategoriesNot Classified
Safety data
- F
- 10-23
- wgk
- 3
- safety_code
- 23-24/25
Chemistry & industry
Applications
UsesMethyl ricinelaidate is a biochemical assay reagent.
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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