[1,1'-BI(Cycloheptane)]-1,1'-diol
Basic information
- CAS
27956-09-8- Standard SMILES
OC1(C2(O)CCCCCC2)CCCCCC1- InChIKey
JKWYXYUBKHPVFR-UHFFFAOYSA-N- Molecular formula
- C14H26O2
- Average molar mass
- 226.35 g/mol
- Monoisotopic mass
- 226.19328007
Names & identifiers
- Preferred name
- [1,1'-BI(Cycloheptane)]-1,1'-diol
- IUPAC
- 1-(1-hydroxycycloheptyl)cycloheptan-1-ol
Names & synonyms
27956-09-8NSC124122[1,1'-BI(CYCLOHEPTANE)]-1,1'-DIOLDTXSID50950642Bi-1,1'-cycloheptane-1,1'-diolBis-1,1'-cycloheptyl-1,1'-diolNSC-124122
Database identifiers
- CAS
27956-09-8- PubChem CID
- 276378
- DTXSID
DTXSID50950642- Nikkaji
- J567.835H
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 185
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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