Basic information
- CAS
35449-37-7- Standard SMILES
CC(C)(CO)CCCCCCCC(C)(C)CO- InChIKey
KGBRTXPEFAHVCL-UHFFFAOYSA-N- Molecular formula
- C15H32O2
- Average molar mass
- 244.41 g/mol
- Monoisotopic mass
- 244.24023026
Names & identifiers
- Preferred name
- 1,11-Undecanediol, 2,2,10,10-tetramethyl-
- IUPAC
- 2,2,10,10-tetramethylundecane-1,11-diol
Names & synonyms
1,11-Undecanediol, 2,2,10,10-tetramethyl-BRN 22374652,2,10,10-Tetramethyl-1,11-undecanediol35449-37-7DTXSID10188949RefChem:214133DTXCID201114402,2,10,10-tetramethylundecane-1,11-diolSCHEMBL11088869KGBRTXPEFAHVCL-UHFFFAOYSA-N
Database identifiers
- CAS
35449-37-7- PubChem CID
- 215316
- DTXSID
DTXSID10188949
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 10
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 165
Related reactions
1 records
Compound notes
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