Basic information
- CAS
83585-76-6- Standard SMILES
CCCCCCCCCCCCOCC1COCCOCCOCCOCCOCCO1- InChIKey
ANBCFBHDAGOOGW-UHFFFAOYSA-N- Molecular formula
- C25H50O7
- Average molar mass
- 462.7 g/mol
- Monoisotopic mass
- 462.35565393
Names & identifiers
- Preferred name
- 2-[(Dodecyloxy)methyl]-1,4,7,10,13,16-hexaoxacyclooctadecane
- IUPAC
- 2-(dodecoxymethyl)-1,4,7,10,13,16-hexaoxacyclooctadecane
Names & synonyms
83585-76-62-[(DODECYLOXY)METHYL]-1,4,7,10,13,16-HEXAOXACYCLOOCTADECANEDTXSID40511600
Database identifiers
- CAS
83585-76-6- PubChem CID
- 12857504
- DTXSID
DTXSID40511600- Nikkaji
- J445.058B
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 13
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 357
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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