Basic information
- CAS
7510-30-7- Standard SMILES
CCCCCC1OC(CCCCC)OC(CCCCC)O1- InChIKey
DWHYTUCIGWHOBO-UHFFFAOYSA-N- Molecular formula
- C18H36O3
- Average molar mass
- 300.5 g/mol
- Monoisotopic mass
- 300.26644501
Names & identifiers
- Preferred name
- 2,4,6-Tripentyl-1,3,5-trioxane
- IUPAC
- 2,4,6-tripentyl-1,3,5-trioxane
Names & synonyms
2,4,6-tripentyl-1,3,5-trioxane7510-30-7DTXSID40324070RefChem:245877DTXCID70275187NSC405653SCHEMBL11257323NSC-405653
Database identifiers
- CAS
7510-30-7- PubChem CID
- 347147
- DTXSID
DTXSID40324070- Nikkaji
- J3.036.098B
Properties
Computed structural properties
- XLogP
- 7
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 12
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 182
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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