2,3-Dihydroxypropyl (12Z)-icos-12-enoate
Basic information
- CAS
62207-88-9- Standard SMILES
CCCCCCC/C=C\CCCCCCCCCCC(=O)OCC(O)CO- InChIKey
MLIFROIPPVISCY-HJWRWDBZSA-N- Molecular formula
- C23H44O4
- Average molar mass
- 384.6 g/mol
- Monoisotopic mass
- 384.32395988
Names & identifiers
- Preferred name
- 2,3-Dihydroxypropyl (12Z)-icos-12-enoate
- IUPAC
- 2,3-dihydroxypropyl (Z)-icos-12-enoate
- English name
- Mono-11-eicosenoin (C20:1,-cis-11)
- Molecular formula
- C23H44O4
- Molecular weight
- 0
Names & synonyms
DTXSID207454862,3-Dihydroxypropyl (12Z)-icos-12-enoateMONO-11-EICOSENOIN (C20:1,-CIS-11)MonoicosenoinMono-11-eicosenoinMono-11(Z)-eicosenoinmono-cis-11-eicosenoinMONO-11-EICOSENOIN (C20Mono-11(Z)-eicosenoin(mixture)1-(cis-11-Eicosenoyl)-rac-glycerolMono-11-eicosenoin, Monoicosenoin
Database identifiers
- CAS
62207-88-9- PubChem CID
- 71308409
- DTXSID
DTXSID20745486
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 21
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 341
Physicochemical properties
- storage temp.
- 20 °C · −20°C
- solubility
- 10 mg/ml; · DMF: 10mg/ml; Ethanol: 10mg/ml
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Danger
- Hazard statements
- 225 · H225-H302+H312+H332-H319
- Precautionary statements
- 210 · P210-P233-P240-P241-P242-P243-P261-P264-P270-P271-P280-P301+P312-P303+P361+P353-P304+P340-P305+P351+P338-P321-P330-P362+P364-P337+P313-P370+P378-P403+P235-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS07
- Hazard statements
- H225-H302+H312+H332-H319
- Precautionary statements
- P210-P233-P240-P241-P242-P243-P261-P264-P270-P271-P280-P301+P312-P303+P361+P353-P304+P340-P305+P351+P338-P321-P330-P362+P364-P337+P313-P370+P378-P403+P235-P501
Chemistry & industry
Applications
UsesMono-11(Z)-eicosenoin is a monoacylglycerol that contains Gondoic acid (HY-W013242).
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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