Basic information
- CAS
24393-13-3- Standard SMILES
Oc1cccc(C2OCCCO2)c1- InChIKey
VHJWMDJIOFWMIG-UHFFFAOYSA-N- Molecular formula
- C10H12O3
- Average molar mass
- 180.2 g/mol
- Monoisotopic mass
- 180.07864424
Names & identifiers
- Preferred name
- 3-(1,3-Dioxan-2-yl)phenol
- IUPAC
- 3-(1,3-dioxan-2-yl)phenol
Names & synonyms
3-(1,3-dioxan-2-yl)phenol24393-13-3DTXSID00351347RefChem:273124DTXCID80302413Oprea1_617142SCHEMBL7388541SBB000216AKOS006239036ST024150
Database identifiers
- CAS
24393-13-3- PubChem CID
- 698281
- DTXSID
DTXSID00351347
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 154
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…