1-(2-Butylbutoxy)propan-2-ol
Basic information
- CAS
1559-39-3- Standard SMILES
CCCCC(CC)COCC(C)O- InChIKey
BTIMJGKRHNTHIU-UHFFFAOYSA-N- Molecular formula
- C11H24O2
- Average molar mass
- 188.31 g/mol
- Monoisotopic mass
- 188.17763
Names & identifiers
- Preferred name
- 1-(2-Butylbutoxy)propan-2-ol
- IUPAC
- 1-(2-ethylhexoxy)propan-2-ol
- English name
- 1-(2-butylbutoxy)propan-2-ol
- Molecular formula
- C11H24O2
- Molecular weight
- 188.31
Names & synonyms
1559-39-31-(2-Butylbutoxy)propan-2-ol1-(2-ethylhexoxy)propan-2-ol1-[(2-ethylhexyl)oxy]propan-2-olNSC70017EINECS 216-324-2SCHEMBL425147SCHEMBL4929344DTXSID70935315BTIMJGKRHNTHIU-UHFFFAOYSA-NNSC 70017NSC-70017
Show more names
1-(2-Butylbutoxy)-2-propanol2-Propanol, 1-[(2-ethylhexyl)oxy]-
AKOS011044333NS00048995
Database identifiers
- CAS
1559-39-3- PubChem CID
- 98029
- DTXSID
DTXSID70935315- EC Number
- 216-324-2
- Nikkaji
- J206.787K
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 104
Physicochemical properties
- Boiling point
- 101.5 · 101.5-102 °C(Press: 10 Torr)
- Density
- 0.871 g/cm3 · 0.871 g/cm3
- pka
- 14.48 · 14.48±0.20(Predicted)
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Related reactions
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Compound notes
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