Basic information
- CAS
56052-54-1- Standard SMILES
COc1ccccc1CCC(O)(c1ccccc1)c1ccccc1- InChIKey
ODLQMEXOOSTSOF-UHFFFAOYSA-N- Molecular formula
- C22H22O2
- Average molar mass
- 318.4 g/mol
- Monoisotopic mass
- 318.16197994
Names & identifiers
- Preferred name
- 2-Methoxy-alpha,alpha-diphenylbenzenepropanol
- IUPAC
- 3-(2-methoxyphenyl)-1,1-diphenylpropan-1-ol
- English name
- 2-Methoxy-α,α-diphenylbenzene-1-propanol
- Molecular formula
- C22H22O2
- Molecular weight
- 318.41
Names & synonyms
56052-54-1RefChem:2627012-Methoxy-alpha,alpha-diphenylbenzenepropanol3-(2-methoxyphenyl)-1,1-diphenylpropan-1-olBenzenepropanol, 2-methoxy-.alpha.,.alpha.-diphenyl-ODLQMEXOOSTSOF-UHFFFAOYSA-NDTXSID7012874982-Methoxy-I+/-,I+/--diphenylbenzenepropanol3-(2-Methoxyphenyl)-1,1-diphenyl-1-propanol #Benzenepropanol, 2-methoxy-α,α-diphenyl-2-Methoxy-α,α-diphenylbenzene-1-propanol
Database identifiers
- CAS
56052-54-1- PubChem CID
- 602995
- DTXSID
DTXSID701287498- Nikkaji
- J143.295H
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 337
Physicochemical properties
- Boiling point
- 465.4 · 465.4±40.0 °C(Predicted)
- Density
- 1.117 · 1.117±0.06 g/cm3(Predicted)
- pka
- 13.45 · 13.45±0.29(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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