2,4-Bis(trifluoromethyl)benzyl alcohol
Basic information
- CAS
143158-15-0- Standard SMILES
OCc1ccc(C(F)(F)F)cc1C(F)(F)F- InChIKey
NDHDRXKQSOFDNV-UHFFFAOYSA-N- Molecular formula
- C9H6F6O
- Average molar mass
- 244.13 g/mol
- Monoisotopic mass
- 244.03228378
Names & identifiers
- Preferred name
- 2,4-Bis(trifluoromethyl)benzyl alcohol
- IUPAC
- [2,4-bis(trifluoromethyl)phenyl]methanol
- English name
- 2,4-Bis(trifluoromethyl)benzyl alcohol
- Molecular formula
- C9H6F6O
- Molecular weight
- 244.13
Names & synonyms
143158-15-02,4-Bis(trifluoromethyl)benzyl alcohol(2,4-Bis(trifluoromethyl)phenyl)methanol[2,4-bis(trifluoromethyl)phenyl]methanolMFCD00042491[2,4-bis(trifluoromethyl)phenyl]methan-1-olBenzenemethanol, 2,4-bis(trifluoromethyl)-2,4-di(trifluoromethyl)benzyl alcohol2,4 - Bis(trifluoromethyl)benzyl alcohol2,4-bis(trifluoromethyl)benzylalcohol98%(2,4-Bis-trifluoromethyl-phenyl)-methanol2,4-bis(trifluoromethyl)benzyl alcohol 98%
Show more names
RARECHEM AL BD 03442,4-bis(trifluoromethyl)benzenemethylol
SCHEMBL1993639SCHEMBL3278364DTXSID80371149CL9296SBB099808AKOS015852795PS-75382,4-Bis(Trifluoromethyl)-Benzenemethanol
Database identifiers
- CAS
143158-15-0- PubChem CID
- 2736131
- DTXSID
DTXSID80371149- EC Number
- 670-623-6
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 233
Physicochemical properties
- Boiling point
- 181.3 · 181.3±35.0 °C(Predicted)
- Density
- 1.433 · 1.433±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 13.59 · 13.59±0.10(Predicted)
- Appearance
- White to off-white Solid
- CAS DataBase Reference
- 143158 · 143158-15-0(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- Hazard Codes
- Xi,Xn
- Risk Statements
- 36 · 36/37/38-36-22
- Safety Statements
- 26 · 26-36
- HazardClass
- IRRITANT
- HS Code
- 2906290090 · 2906290090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2906290090
- risk_code
- 36/37/38-36-22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,Xn
- safety_code
- 26-36
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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