Basic information
- Standard SMILES
Cc1oc(-c2ccccc2)cc1C(Cl)C1CCOCC1- InChIKey
VYIIFBAYOPYTFW-UHFFFAOYSA-N- Molecular formula
- C17H19ClO2
- Average molar mass
- 290.8 g/mol
Names & identifiers
- Preferred name
- 4-[chloro(2-methyl-5-phenylfuran-3-yl)methyl]tetrahydro-2H-pyran
- IUPAC
- 4-[chloro-(2-methyl-5-phenylfuran-3-yl)methyl]oxane
Names & synonyms
SCHEMBL3102132VYIIFBAYOPYTFW-UHFFFAOYSA-N4-[chloro(2-methyl-5-phenylfuran-3-yl)methyl]tetrahydro-2H-pyran
Database identifiers
- PubChem CID
- 68512423
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 22.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 297
Related reactions
2 records
Compound notes
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