Basic information
- CAS
2144-41-4- Standard SMILES
C[C@@H]1CC[C@H](C)O1- InChIKey
OXMIDRBAFOEOQT-OLQVQODUSA-N- Molecular formula
- C6H12O
- Average molar mass
- 100.16 g/mol
- Monoisotopic mass
- 100.088815
Names & identifiers
- Preferred name
- 2,5-Dimethyloxolane, cis-
- IUPAC
- (2R,5S)-2,5-dimethyloxolane
- English name
- cis-2,5-Dimethyloxolane
- Molecular formula
- C6H12O
- Molecular weight
- 100.16
Names & synonyms
cis-2,5-Dimethyltetrahydrofuran2144-41-4cis-2,5-Dimethyloxolane2,5-Dimethyloxolane, cis-O7NB7572GUUNII-O7NB7572GU2,5-Dimethyltetrahydrofuran, (Z)-FURAN, TETRAHYDRO-2,5-DIMETHYL-, (2R,5S)-REL-RefChem:197436OXMIDRBAFOEOQT-OLQVQODUSA-NFuran, tetrahydro-2,5-dimethyl-, cis-Rel-(2R,5S)-2,5-dimethyltetrahydrofuran
Show more names
CIS-2,5-DIMETHYLTERAHYDROFURAN
cis-Tetrahydro-2,5-Dimethylfuran(2R,5S)-2,5-dimethyloxolanestarbld0003326SCHEMBL9062787SCHEMBL16294992SCHEMBL16294994Q27285445
Database identifiers
- CAS
2144-41-4- PubChem CID
- 16508
- UNII
- O7NB7572GU
- Nikkaji
- J100.738F
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 53.2
Physicochemical properties
- Boiling point
- 91 · 91-92 °C
- Density
- 0.836 · 0.836±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- FDA UNII
- 7 NB7572GU · O7NB7572GU
Chemistry & industry
Applications
Usescis-2,5-Dimethyltetrahydrofuran is a byproduct of the catalytic conversion of sugars and polyols to biomass-derived carbohydrates. Dihydrofuranyl derivative.
Suppliers1 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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