Triacotane, 2-methyl-
Basic information
- CAS
1560-72-1- Standard SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCCCC(C)C- InChIKey
XXXQDPROWGQIIR-UHFFFAOYSA-N- Molecular formula
- C31H64
- Average molar mass
- 436.8 g/mol
- Monoisotopic mass
- 436.50080204
Overview
2-methyl-triacotane has been reported in Solanum tuberosum, Cryptotermes cynocephalus, and other organisms with data available.
Names & identifiers
- Preferred name
- Triacotane, 2-methyl-
- IUPAC
- 2-methyltriacontane
Names & synonyms
2-Methyltriacontane1560-72-1Triacotane, 2-methyl-KXJ9XHT2ASRefChem:1100310IsohentriacontaneTriacontane, 2-methyl-90386-48-4UNII-KXJ9XHT2AS2-methyl-triacotaneTriacontane, 2-methylSCHEMBL2201024
Show more names
SCHEMBL4404157DTXSID4075087SCHEMBL27161079XXXQDPROWGQIIR-UHFFFAOYSA-NLMFA11000353Q27282486
Database identifiers
- CAS
1560-72-1、90386-48-4- PubChem CID
- 73796
- DTXSID
DTXSID4075087- UNII
- KXJ9XHT2AS
- Nikkaji
- J948.199K
Properties
Computed structural properties
- XLogP
- 16.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 27
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 292
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Hydrocarbons [FA11]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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