alpha-Methyl-beta-phenylbenzeneethanol
Basic information
- CAS
29338-49-6- Standard SMILES
CC(O)C(c1ccccc1)c1ccccc1- InChIKey
BDZAWYBXBHTHFM-UHFFFAOYSA-N- Molecular formula
- C15H16O
- Average molar mass
- 212.29 g/mol
- Monoisotopic mass
- 212.12011513
Names & identifiers
- Preferred name
- alpha-Methyl-beta-phenylbenzeneethanol
- IUPAC
- 1,1-diphenylpropan-2-ol
- English name
- 1,1-Diphenyl-2-propanol
- Molecular formula
- C15H16O
- Molecular weight
- 212.29
Names & synonyms
29338-49-6alpha-Methyl-beta-phenylphenethyl alcoholRefChem:1076532alpha-Methyl-beta-phenylbenzeneethanol249-574-61,1-diphenylpropan-2-ol1,1-Diphenyl-2-propanolBenzeneethanol, alpha-methyl-beta-phenyl-1,1-Diphenylpropane-2-olEINECS 249-574-6NSC2444763-diphenylpropan-2-ol
Show more names
1 1-DIPHENYL-2-PROPANOL 98%Benzeneethanol, α-methyl-β-phenyl-
SCHEMBL5873452SCHEMBL79600041,1-Diphenyl-2-propanol,98%BDZAWYBXBHTHFM-UHFFFAOYSA-NDTXSID501031184MFCD00004524AKOS000249591NSC 244476
Database identifiers
- CAS
29338-49-6- PubChem CID
- 99867
- DTXSID
DTXSID501031184- EC Number
- 249-574-6
- Nikkaji
- J150.093G
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 172
Physicochemical properties
- Melting point
- 59 · 59-62 °C(lit.)
- Boiling point
- 312.13 °C · 312.13°C (rough estimate)
- Density
- 1.0018 · 1.0018 (rough estimate)
- refractive index
- 1.5705 · 1.5705 (estimate)
- pka
- 14.69 · 14.69±0.20(Predicted)
- Safety Statements
- 24 · 24/25
- WGK Germany
- 3 · 3
- HS Code
- 29062900 · 29062900
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- hs_code
- 29062900
- safety_code
- 24/25
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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