Cyclododecanol, TFA
Basic information
- CAS
6222-01-1- Standard SMILES
O=C(OC1CCCCCCCCCCC1)C(F)(F)F- InChIKey
ZZQDHMBQHCVNRA-UHFFFAOYSA-N- Molecular formula
- C14H23F3O2
- Average molar mass
- 280.33 g/mol
- Monoisotopic mass
- 280.16501446
Names & identifiers
- Preferred name
- Cyclododecanol, TFA
- IUPAC
- cyclododecyl 2,2,2-trifluoroacetate
Names & synonyms
Cyclododecanol, TFADTXSID403355606222-01-1RefChem:335011DTXCID40286649ZZQDHMBQHCVNRA-UHFFFAOYSA-NCyclododecyl trifluoroacetate
Database identifiers
- CAS
6222-01-1- PubChem CID
- 526008
- DTXSID
DTXSID40335560- Nikkaji
- J1.467.752F
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 252
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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