2-Furanmethanol, tetrahydro-, acetate, (S)-
Basic information
- CAS
117178-65-1- Standard SMILES
CC(=O)OC[C@@H]1CCCO1- InChIKey
AAQDYYFAFXGBFZ-ZETCQYMHSA-N- Molecular formula
- C7H12O3
- Average molar mass
- 144.17 g/mol
- Monoisotopic mass
- 144.07864424
Names & identifiers
- Preferred name
- 2-Furanmethanol, tetrahydro-, acetate, (S)-
- IUPAC
- [(2S)-oxolan-2-yl]methyl acetate
Names & synonyms
UNII-94GX32XPTA94GX32XPTA2-Furanmethanol, tetrahydro-, acetate, (S)-2-Furanmethanol, tetrahydro-, acetate, (2S)-117178-65-1(+)-tetrahydrofurfuryl acetateSCHEMBL17269992acetic acid tetrahydro-furfuryl esterTETRAHYDROFURFURYL ACETATE, (+)-Q27271683
Database identifiers
- CAS
117178-65-1- PubChem CID
- 7224985
- UNII
- 94GX32XPTA
- Nikkaji
- J968.433F
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 122
Experimental & physicochemical properties
SpringerMaterials PropertiesDielectric constant
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Compound notes
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