Tetratriacontanoic acid
Basic information
- CAS
38232-04-1- Standard SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O- InChIKey
UTGPYHWDXYRYGT-UHFFFAOYSA-N- Molecular formula
- C34H68O2
- Average molar mass
- 508.9 g/mol
- Monoisotopic mass
- 508.52193141
Overview
Tetratriacontanoic acid is a straight-chain saturated fatty acid that is tetratriacontane in which one of the methyl groups has been oxidised to the corresponding carboxylic acid. It has a role as a metabolite. It is an ultra-long-chain fatty acid and a straight-chain saturated fatty acid. It is a conjugate acid of a tetratriacontanoate.
Names & identifiers
- Preferred name
- Tetratriacontanoic acid
- IUPAC
- tetratriacontanoic acid
- English name
- Tetratriacontanoic acid
- Molecular formula
- C34H68O2
- Molecular weight
- 508.9
Names & synonyms
Tetratriacontanoic acidGeddic acidGheddic acid38232-04-1n-tetratriacontanoic acidVE67QZ85C0C34:0CHEBI:76216DTXSID00191624RefChem:1099754DTXCID40114115FA 34:0
Show more names
UNII-VE67QZ85C0SCHEMBL135988Geddic acid; C34:0; Ghedoic acidLMFA01010034Q2823321
Database identifiers
- CAS
38232-04-1- PubChem CID
- 94485
- DTXSID
DTXSID00191624- ChEBI
CHEBI:76216- UNII
- VE67QZ85C0
- Nikkaji
- J123.066B
Properties
Computed structural properties
- XLogP
- 16.1
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 32
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 406
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Straight chain fatty acids [FA0101]
Physicochemical properties
- Boiling point
- 514.92 °C · 514.92°C (rough estimate)
- Density
- 0.8795 · 0.8795 (rough estimate)
- refractive index
- 1.497 · 1.4970 (estimate)
- FDA UNII
- 67 QZ85C0 · VE67QZ85C0
Chemistry & industry
Additional notes
DefinitionChEBI: A straight-chain saturated fatty acid that is tetratriacontane in which one of the methyl groups has been oxidised to the corresponding carboxylic acid.
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