Basic information
- CAS
57189-00-1- Standard SMILES
C#CC(CCC)OC(C)(C)C- InChIKey
GFUMIIXNZURYNB-UHFFFAOYSA-N- Molecular formula
- C10H18O
- Average molar mass
- 154.25 g/mol
- Monoisotopic mass
- 154.13576519
Names & identifiers
- Preferred name
- 3-(1,1-Dimethylethoxy)-1-hexyne
- IUPAC
- 3-[(2-methylpropan-2-yl)oxy]hex-1-yne
Names & synonyms
3-(1,1-Dimethylethoxy)-1-hexyne57189-00-1RefChem:2730723-tert-butoxy-hex-1-yne3-tert-Butoxyhex-1-yneDTXSID801304055tert-butyl 1-propyl-2-propynyl ether
Database identifiers
- CAS
57189-00-1- PubChem CID
- 10997331
- DTXSID
DTXSID801304055
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 144
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…