6-Oxodecanoic acid
Basic information
- CAS
4144-60-9- Standard SMILES
CCCCC(=O)CCCCC(=O)O- InChIKey
HWBQEMISDOEBJH-UHFFFAOYSA-N- Molecular formula
- C10H18O3
- Average molar mass
- 186.25 g/mol
- Monoisotopic mass
- 186.12559443
Overview
6-oxo capric acid is an oxo carboxylic acid.
Names & identifiers
- Preferred name
- 6-Oxodecanoic acid
- IUPAC
- 6-oxodecanoic acid
- English name
- 6-Oxodecanoicacid
- Molecular formula
- C10H18O3
- Molecular weight
- 186.25
Names & synonyms
6-Oxodecanoic acid4144-60-96-oxo capric acid6-oxo-decanoic acidMFCD013201636-OxodecanoicacidSCHEMBL1041632DTXSID00961687CHEBI:180134LMFA01060031AKOS006277609H84995
Show more names
Decanoic acid, 6-oxo-
F207262
Database identifiers
- CAS
4144-60-9- PubChem CID
- 5282983
- DTXSID
DTXSID00961687- ChEBI
CHEBI:180134- Nikkaji
- J206.115E
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 164
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Oxo fatty acids [FA0106]
Chemistry & industry
Upstream & downstream products
Downstream products
Additional notes
DefinitionChEBI: 6-oxo capric acid is an oxo carboxylic acid.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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