Basic information
- Standard SMILES
CC(C)(O)c1ccc(OCc2ccccc2)cc1- InChIKey
ZYKIOBGGPQKTSK-UHFFFAOYSA-N- Molecular formula
- C16H18O2
- Average molar mass
- 242.31 g/mol
Names & identifiers
- Preferred name
- alpha,alpha-Dimethyl-4-(phenylmethoxy)benzenemethanol
- IUPAC
- 2-(4-phenylmethoxyphenyl)propan-2-ol
- English name
- 2-(4-(benzyloxy)phenyl)propan-2-ol
- Molecular formula
- C16H18O2
- Molecular weight
- 242.31
Names & synonyms
94571-13-8ALPHA,ALPHA-DIMETHYL-4-(PHENYLMETHOXY)BENZENEMETHANOL2-(4-(Benzyloxy)phenyl)propan-2-ol2-[4-(BENZYLOXY)PHENYL]PROPAN-2-OL2-(4-phenylmethoxyphenyl)propan-2-ol2-[4-(Benzyloxy)phenyl]-2-propanolMFCD16620480SCHEMBL4602365ZYKIOBGGPQKTSK-UHFFFAOYSA-N2-(4-benzyloxyphenyl)propan-2-ol2-(4-benzyloxy-phenyl)-propan-2-olSY272687
Show more names
1-methyl-1-ethanolBenzenemethanol, α,α-dimethyl-4-(phenylmethoxy)-
CS-0458137EN300-1869584
Database identifiers
- CAS
94571-13-8
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 235
Physicochemical properties
- Boiling point
- 385.3 · 385.3±30.0 °C(Predicted)
- Density
- 1.092 · 1.092
- pka
- 14.66 · 14.66±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 data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
上海肯恩化学科技有限公司13701870891; 02152215958 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
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Linked notes
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