Basic information
- CAS
16899-09-5- Standard SMILES
CCCCC(O)CCCCCCC(=O)O- InChIKey
PPHSOXADSWJILD-UHFFFAOYSA-N- Molecular formula
- C12H24O3
- Average molar mass
- 216.32 g/mol
- Monoisotopic mass
- 216.17254462
Overview
8-hydroxylauric acid is a hydroxy fatty acid comprising lauric acid carrying a single hydroxy substituent at position 8. It is a hydroxy fatty acid and a medium-chain fatty acid. It is functionally related to a dodecanoic acid. It is a conjugate acid of an 8-hydroxylaurate.
Names & identifiers
- Preferred name
- 8-Hydroxydodecanoic acid
- IUPAC
- 8-hydroxydodecanoic acid
- English name
- 8-hydroxylauric acid
- Molecular formula
- C12H24O3
- Molecular weight
- 216.32
Names & synonyms
8-hydroxydodecanoic acid8-hydroxylauric acid(omega-4)-hydroxylauric acid8-hydroxy-dodecanoic acidCHEBI:167567DTXSID20560515RefChem:312083DTXCID1051129316899-09-5Dodecanoic acid, 8-hydroxy-SCHEMBL1882579CHEMBL4277376
Show more names
G64620
Database identifiers
- CAS
16899-09-5- PubChem CID
- 14454530
- DTXSID
DTXSID20560515- ChEMBL
CHEMBL4277376- ChEBI
CHEBI:167567- Nikkaji
- J262.043J
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 157
Physicochemical properties
- Boiling point
- 350.2 · 350.2±25.0 °C(Predicted)
- Density
- 0.987 · 0.987±0.06 g/cm3(Predicted)
- pka
- 4.77 · 4.77±0.10(Predicted)
Chemistry & industry
Suppliers4 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
成都格里迈特医药技术有限公司17308078590; 15928855497 · [email protected]
成都卡麦尔医药科技有限公司028-67136579 15828051124 · [email protected]
江苏艾康生物医药研发有限公司17714375163 · [email protected]
Additional notes
DefinitionChEBI: 8-hydroxylauric acid is a hydroxy fatty acid comprising lauric acid carrying a single hydroxy substituent at position 8. It is a hydroxy fatty acid and a medium-chain fatty acid. It is functionally related to a dodecanoic acid. It is a conjugate acid of an 8-hydroxylaurate.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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