Basic information
- CAS
55724-04-4- Standard SMILES
COCCCC(C)(C)O- InChIKey
WQRCPZWIKZVUTI-UHFFFAOYSA-N- Molecular formula
- C7H16O2
- Average molar mass
- 132.2 g/mol
- Monoisotopic mass
- 132.11502975
Names & identifiers
- Preferred name
- 5-Methoxy-2-methyl-2-pentanol
- IUPAC
- 5-methoxy-2-methylpentan-2-ol
- English name
- 5-Methoxy-2-methyl-2-pentanol
- Molecular formula
- C7H16O2
- Molecular weight
- 132.2
Names & synonyms
5-METHOXY-2-METHYL-2-PENTANOL55724-04-4DTXSID30204271RefChem:1073057DTXCID301267625-methoxy-2-methylpentan-2-ol2-Pentanol, 5-methoxy-2-methyl-SCHEMBL1394318WQRCPZWIKZVUTI-UHFFFAOYSA-N5-Methoxy-2-methyl-2-pentanol #EN300-1844391
Database identifiers
- CAS
55724-04-4- PubChem CID
- 41561
- DTXSID
DTXSID30204271- Nikkaji
- J113.863D
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 69.3
Physicochemical properties
- Boiling point
- 178.5 · 178.5±8.0 °C(Predicted)
- Density
- 0.893 · 0.893±0.06 g/cm3(Predicted)
- pka
- 15.21 · 15.21±0.29(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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