Basic information
- CAS
321903-49-5- Standard SMILES
CC(=O)C[C@H]1COC[C@@H]1C(C)C- InChIKey
FFXFVSAKXVHNIA-VHSXEESVSA-N- Molecular formula
- C10H18O2
- Average molar mass
- 170.25 g/mol
- Monoisotopic mass
- 170.13067981
Names & identifiers
- Preferred name
- 1-[(3R,4R)-4-propan-2-yloxolan-3-yl]propan-2-one
- IUPAC
- 1-[(3R,4R)-4-propan-2-yloxolan-3-yl]propan-2-one
- English name
- 2-Propanone,1-[(3R,4R)-tetrahydro-4-(1-methylethyl)-3-furanyl]-,rel-(9CI)
- Molecular formula
- C10H18O2
- Molecular weight
- 170.25
Names & synonyms
2-Propanone, 1-[(3R,4R)-tetrahydro-4-(1-methylethyl)-3-furanyl]-, rel-2-Propanone,1-[(3R,4R)-tetrahydro-4-(1-methylethyl)-3-furanyl]-,rel-(9CI)
Database identifiers
- CAS
321903-49-5- PubChem CID
- 102371077
- Nikkaji
- J1.424.707F
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 163
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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