2-(1-Hydroxycycloheptyl)-furan
Basic information
- CAS
115754-89-7- Standard SMILES
OC1(c2ccco2)CCCCCC1- InChIKey
AURDSNDBCQNDDI-UHFFFAOYSA-N- Molecular formula
- C11H16O2
- Average molar mass
- 180.24 g/mol
- Monoisotopic mass
- 180.11502975
Names & identifiers
- Preferred name
- 2-(1-Hydroxycycloheptyl)-furan
- IUPAC
- 1-(furan-2-yl)cycloheptan-1-ol
Names & synonyms
2-(1-Hydroxycycloheptyl)-furan115754-89-71-(2-Furyl)cycloheptanol #SCHEMBL28366218Cycloheptanol, 1-(2-furanyl)-AURDSNDBCQNDDI-UHFFFAOYSA-NDTXSID501365581AKOS013265304
Database identifiers
- CAS
115754-89-7- PubChem CID
- 579129
- DTXSID
DTXSID501365581
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 33.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 159
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Compound notes
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