Basic information
- CAS
5578-80-3- Standard SMILES
O=CCCCCCCCCC(=O)O- InChIKey
FYURGFQVSMALOD-UHFFFAOYSA-N- Molecular formula
- C10H18O3
- Average molar mass
- 186.25 g/mol
- Monoisotopic mass
- 186.12559443
Overview
10-oxocapric acid is a capric acid derivative carrying an oxo group at position 10. It is an aldehydic acid, an oxo monocarboxylic acid, a medium-chain fatty acid and an omega-oxo fatty acid. It is functionally related to a decanoic acid. It is a conjugate acid of a 10-oxocaprate.
Names & identifiers
- Preferred name
- 9-Formylnonanoic acid
- IUPAC
- 10-oxodecanoic acid
- English name
- 9-formylnonanoic acid
- Molecular formula
- C10H18O3
- Molecular weight
- 186.24812
Names & synonyms
10-oxodecanoic acid9-Formylnonanoic acid5578-80-310-oxocapric acidDecanoic acid, 10-oxo-Sebacaldehydic acid10-oxo-decanoic acidEINECS 226-958-143VX3L2AUTMFCD20638256NSC-6561710-oxodecanoicacid
Show more names
ω-oxydecanocarboxylic acid
sebacic semialdehydeomega-oxocapric acidomega-oxodecanoic acid9-aldehydononanoic acid9-formylpelargonic acidUNII-43VX3L2AUTNCIOpen2_000111omega-oxydecanocarboxylic acid
Database identifiers
- CAS
5578-80-3- PubChem CID
- 79686
- DTXSID
DTXSID00204344- ChEBI
CHEBI:17130- UNII
- 43VX3L2AUT
- EC Number
- 226-958-1
- Nikkaji
- J225.032B
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 143
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Oxo fatty acids [FA0106]
Physicochemical properties
- Melting point
- 110 °C · 110 °C
- Boiling point
- 319.4 · 319.4±25.0 °C(Predicted)
- Density
- 1.003 · 1.003±0.06 g/cm3(Predicted)
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Low-Melting Solid
- pka
- 4.78 · 4.78±0.10(Predicted)
- color
- White to Off-White
- FDA UNII
- 43 VX3L2AUT · 43VX3L2AUT
Chemistry & industry
Applications
Uses10-Oxodecanoic Acid is used as a reactant in the preparation of fluorescent probe-based reactome array for detection, immobilization and isolation of enzymes.
Suppliers8 total
武汉布林科技有限公司3456065315 13260619011 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
上海创焰化学科技有限公司021-11111111 11111111111 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
合肥启明医药科技有限公司15105695099 · [email protected]
上海普黎康化工科技有限公司021-54321516 17717324060 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Additional notes
DefinitionChEBI: 10-oxocapric acid is a capric acid derivative carrying an oxo group at position 10. It is an oxo monocarboxylic acid, an aldehydic acid, a medium-chain fatty acid and an omega-oxo fatty acid. It is functionally related to a decanoic acid. It is a conjugate acid of a 10-oxocaprate.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…