Basic information
- CAS
69775-79-7- Standard SMILES
CCCCCCOC(C)(C)C- InChIKey
XSBHWHZJHSUCOI-UHFFFAOYSA-N- Molecular formula
- C10H22O
- Average molar mass
- 158.28 g/mol
- Monoisotopic mass
- 158.16706532
Names & identifiers
- Preferred name
- Hexyl t-butyl ether
- IUPAC
- 1-[(2-methylpropan-2-yl)oxy]hexane
- English name
- Hexane, 1-(1,1-dimethylethoxy)-
- Molecular formula
- C10H22O
- Molecular weight
- 158.28
Names & synonyms
69775-79-7hexyl t-butyl etherDTXSID70338241RefChem:1086673DTXCID50289328tert-Butyl n-hexyl ether1-(TERT-BUTOXY)HEXANE1-[(2-methylpropan-2-yl)oxy]hexane1-tert-butoxyhexane6-t-butoxyhexanehexyl-t-butyl ethert-butyl hexyl ether
Show more names
tert-butyl 1-hexyl etherHexane, 1-(1,1-dimethylethoxy)-
Ether, hexyl t-butyln-hexyl t-butyl ethertert-Butyl hexyl ether #SCHEMBL278721SCHEMBL1405724SCHEMBL1405725SCHEMBL28054359SCHEMBL28282387
Database identifiers
- CAS
69775-79-7- PubChem CID
- 547839
- DTXSID
DTXSID70338241- Nikkaji
- J1.905.363F
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 81.4
Physicochemical properties
- Boiling point
- 59 °C · 59 °C(Press: 15 Torr)
- Density
- 0.791 · 0.791±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers6 total
天津狄克特科技有限公司22-58627059 13920586291 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
Richest Group Ltd18017061086 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
4 records
Compound notes
Loading…