Basic information
- CAS
1657-60-9- Standard SMILES
CC(C)(C)C(O)(c1ccccc1)c1ccccc1- InChIKey
YOVSPPKJDDWJML-UHFFFAOYSA-N- Molecular formula
- C17H20O
- Average molar mass
- 240.34 g/mol
- Monoisotopic mass
- 240.15141526
Names & identifiers
- Preferred name
- tert-Butyldiphenylmethanol
- IUPAC
- 2,2-dimethyl-1,1-diphenylpropan-1-ol
- English name
- tert-Butyldiphenylmethanol
- Molecular formula
- C17H20O
- Molecular weight
- 240.34
Names & synonyms
tert-Butyldiphenylmethanol1657-60-9t-ButyldiphenylmethanolDTXSID60168014RefChem:188238DTXCID9090505YOVSPPKJDDWJML-UHFFFAOYSA-N2,2-dimethyl-1,1-diphenylpropan-1-olMFCD00043743Benzenemethanol, |A-(1,1-dimethylethyl)-|A-phenyl-a-tert-ButylbenzhydrolALPHA-TERT-BUTYLBENZHYDROL
Show more names
TIMTEC-BB SBB0083272,2-dimethyl-1,1-di(phenyl)propan-1-olBenzenemethanol, α-(1,1-dimethylethyl)-α-phenyl-
2,2-Dimethyl-1,1-diphenyl-1-propanolSCHEMBL15275691SBB008327AKOS0158378012,2-dimethyl-1,1-diphenyl-propan-1-ol2,2-Dimethyl-1,1-diphenyl-1-propanol #DB-080865ST50828131
Database identifiers
- CAS
1657-60-9- PubChem CID
- 137142
- DTXSID
DTXSID60168014- Nikkaji
- J359.896I
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 233
Physicochemical properties
- Melting point
- 220.5 · 220.5-221.2 °C
- Boiling point
- 179 · 179-180 °C(Press: 11 Torr)
- Density
- 1.054 g/cm3 · 1.054 g/cm3(Temp: 25 °C)
- pka
- 13.61 · 13.61±0.29(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers2 total
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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