Basic information
- CAS
83682-67-1- Standard SMILES
C=CC(O)COCC(O)C=C- InChIKey
SKIOXONYFXKRIC-UHFFFAOYSA-N- Molecular formula
- C8H14O3
- Average molar mass
- 158.19 g/mol
- Monoisotopic mass
- 158.0942943
Names & identifiers
- Preferred name
- 1,1'-Oxybis-3-buten-2-OL
- IUPAC
- 1-(2-hydroxybut-3-enoxy)but-3-en-2-ol
Names & synonyms
83682-67-11,1'-OXYBIS-3-BUTEN-2-OLSCHEMBL34197111,1'-Oxydi(but-3-en-2-ol)DTXSID701003688
Database identifiers
- CAS
83682-67-1- PubChem CID
- 55096
- DTXSID
DTXSID701003688- Nikkaji
- J1.596.189I
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 109
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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