4-Hydroxydecanoic acid
Basic information
- CAS
17369-51-6- Standard SMILES
CCCCCCC(O)CCC(=O)O- InChIKey
QQAVZEYXLCYOKO-UHFFFAOYSA-N- Molecular formula
- C10H20O3
- Average molar mass
- 188.26 g/mol
- Monoisotopic mass
- 188.1412445
Overview
4-Hydroxycapric acid is a carbonyl compound.
Names & identifiers
- Preferred name
- 4-Hydroxydecanoic acid
- IUPAC
- 4-hydroxydecanoic acid
- English name
- 4-Hydroxycapric acid
- Molecular formula
- C10H20O3
- Molecular weight
- 188.26
Names & synonyms
4-HYDROXYDECANOIC ACID17369-51-6DTXSID10938421RefChem:912581DTXCID901366955Decanoic acid, 4-hydroxy-4-hydroxycapric acid4-hydroxy capric acid4-HYDROXYDECANOICACIDSCHEMBL317386SCHEMBL3343272CHEBI:165409
Show more names
LMFA01050031AKOS010914269CS-0297491EN300-81498G81050
Database identifiers
- CAS
17369-51-6- PubChem CID
- 28499
- DTXSID
DTXSID10938421- ChEBI
CHEBI:165409- Nikkaji
- J262.020K
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 134
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Hydroxy fatty acids [FA0105]
Physicochemical properties
- Boiling point
- 332.9 · 332.9±25.0 °C(Predicted)
- Density
- 1.011 · 1.011±0.06 g/cm3(Predicted)
- pka
- 4.62 · 4.62±0.10(Predicted)
- LogP
- 2.144 · 2.144 (est)
Chemistry & industry
Additional notes
DefinitionChEBI: 4-Hydroxycapric acid is a carbonyl compound.
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Related reactions
1 records
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