Basic information
- CAS
22402-45-5- Standard SMILES
OCC(CO)Oc1ccc(O)cc1- InChIKey
IGNIFCHMNYFZNK-UHFFFAOYSA-N- Molecular formula
- C9H12O4
- Average molar mass
- 184.19 g/mol
- Monoisotopic mass
- 184.07355886
Names & identifiers
- Preferred name
- 1,2-Propanediol, 3-(p-hydroxyphenoxy)-
- IUPAC
- 2-(4-hydroxyphenoxy)propane-1,3-diol
- English name
- 3-(p-Hydroxyphenoxy)-1,2-propanediol
- Molecular weight
- 0
Names & synonyms
1,2-Propanediol, 3-(p-hydroxyphenoxy)-22402-45-5DTXSID60176937RefChem:1052439DTXCID70994283-(p-Hydroxyphenoxy)-1,2-propanediol2-(4-hydroxyphenoxy)propane-1,3-diolBRN 2366226SCHEMBL10748557
Database identifiers
- CAS
22402-45-5- PubChem CID
- 89695
- DTXSID
DTXSID60176937
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 69.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 128
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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