2,3-Butanediol, 2,3-bis(5-methyl-2-furanyl)-
Basic information
- CAS
56335-95-6- Standard SMILES
Cc1ccc(C(C)(O)C(C)(O)c2ccc(C)o2)o1- InChIKey
XTGLXKGAQZHTPR-UHFFFAOYSA-N- Molecular formula
- C14H18O4
- Average molar mass
- 250.29 g/mol
- Monoisotopic mass
- 250.12050905
Names & identifiers
- Preferred name
- 2,3-Butanediol, 2,3-bis(5-methyl-2-furanyl)-
- IUPAC
- 2,3-bis(5-methylfuran-2-yl)butane-2,3-diol
- English name
- 2,3-Bis(5-methyl-2-furanyl)-2,3-butanediol
- Molecular formula
- C14H18O4
- Molecular weight
- 250.29
Names & synonyms
2,3-Bis(5-methyl-2-furanyl)-2,3-butanediol2,3-Butanediol, 2,3-bis(5-methyl-2-furanyl)-XTGLXKGAQZHTPR-UHFFFAOYSA-NDB-3022092,3-Bis(5-methyl-2-furyl)-2,3-butanediol #56335-95-6
Database identifiers
- CAS
56335-95-6- PubChem CID
- 580385
- Nikkaji
- J140.352D
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 66.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 278
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Compound notes
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