1-(2-Furyl)-2,3-dimethyl-1,4-butanediol
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Basic information
- CAS
10564-02-0- Standard SMILES
CC(CO)C(C)C(O)c1ccco1- InChIKey
VSVGERRGVUVKFX-UHFFFAOYSA-N- Molecular formula
- C10H16O3
- Average molar mass
- 184.23 g/mol
- Monoisotopic mass
- 184.10994437
Names & identifiers
- Preferred name
- 1-(2-Furyl)-2,3-dimethyl-1,4-butanediol
- IUPAC
- 1-(furan-2-yl)-2,3-dimethylbutane-1,4-diol
- English name
- 1-(2-Furanyl)-2,3-dimethyl-1,4-butanediol
- Molecular weight
- 0
Names & synonyms
10564-02-01-(2-Furyl)-2,3-dimethyl-1,4-butanediolDTXSID50340726RefChem:223492DTXCID702918071-(furan-2-yl)-2,3-dimethylbutane-1,4-diol1-(2-Furanyl)-2,3-dimethyl-1,4-butanediol1,4-Butanediol, 1-(2-furyl)-2,3-dimethyl-VSVGERRGVUVKFX-UHFFFAOYSA-N1-(2-Furyl)-2,3-dimethyl-1,4-butanediol #
Database identifiers
- CAS
10564-02-0- PubChem CID
- 566809
- DTXSID
DTXSID50340726- Nikkaji
- J99.462F
Properties
Computed structural propertiesFilling in
- XLogP
- 1.1
- Topological polar surface area
- 53.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 149
Related reactions
0 records
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Compound notes
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