Basic information
- CAS
22004-65-5- Standard SMILES
Cc1cccc(C)c1C(O)c1c(C)cccc1C- InChIKey
OKFOGGVYBGIWSE-UHFFFAOYSA-N- Molecular formula
- C17H20O
- Average molar mass
- 240.34 g/mol
- Monoisotopic mass
- 240.15141526
Names & identifiers
- Preferred name
- Bis(2,6-dimethylphenyl)methanol
- IUPAC
- bis(2,6-dimethylphenyl)methanol
- English name
- 2,2',6,6'-tetramethylbenzhydryl alcohol
- Molecular formula
- C17H20O
- Molecular weight
- 240.3401
Names & synonyms
bis(2,6-dimethylphenyl)methanol22004-65-52,2',6,6'-Tetramethylbenzhydryl alcoholEINECS 244-712-1Benzenemethanol,a-(2,6-dimethylphenyl)-2,6-dimethyl-SCHEMBL8372482SCHEMBL8932197TN2938WK3Lalpha-(2,6-Dimethylphenyl)-2,6-dimethylbenzenemethanolBenzenemethanol, alpha-(2,6-dimethylphenyl)-2,6-dimethyl-DTXSID30176444OKFOGGVYBGIWSE-UHFFFAOYSA-N
Show more names
6-diMethylphenyl)-2α-(2,6-Dimethylphenyl)-2,6-dimethylbenzenemethanolα-(2,6-Dimethylphenyl)-2,6-dimethylbenzenemethanolBenzenemethanol, α-(2,6-dimethylphenyl)-2,6-dimethyl-Benzenemethanol, a-(2,6-dimethylphenyl)-2,6-dimethyl-
CS-B0133MFCD03076636AKOS030584870CS-13960NS00027021AM-814/41091915Benzenemethanol, a-(2,6-dimethylphenyl)-2,6-dimethyl- (9CI)
Database identifiers
- CAS
22004-65-5- PubChem CID
- 89144
- DTXSID
DTXSID30176444- UNII
- TN2938WK3L
- EC Number
- 244-712-1
- Nikkaji
- J225.509J
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 216
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Boiling point
- 388.3 · 388.3±11.0 °C(Predicted)
- Density
- 1.035 · 1.035±0.06 g/cm3(Predicted)
- pka
- 13.58 · 13.58±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-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
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Suppliers9 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
斯派螺（武汉）药物研发有限公司[email protected]
Capot Chemical Co.,Ltd.+86-（0）57185586718 +86-13336195806 · [email protected]
上海丝帆医药科技有限公司18916696128 · [email protected]
Capot Chemical Co., Ltd+86 (0) 571 85 58 67 18
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海皓元医药股份有限公司021-58950125 · [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
No reaction records under the current filter.
Compound notes
Loading…