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(R)-(Trifluoromethyl)phenylmethanol

HCID 1472402
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Basic information

CAS
10531-50-7
Standard SMILES
O[C@H](c1ccccc1)C(F)(F)F
InChIKey
VNOMEAQPOMDWSR-SSDOTTSWSA-N
Molecular formula
C8H7F3O
Average molar mass
176.137 g/mol
Monoisotopic mass
176.0448995

Names & identifiers

Preferred name
(R)-(Trifluoromethyl)phenylmethanol
IUPAC
2,2,2-Trifluoro-1-phenylethan-1-ol
English name
(R)-(-)-alpha-(Trifluoromethyl)benzyl alcohol
Molecular formula
C8H7F3O
Molecular weight
176.14

Names & synonyms

(-)-PHENYL(TRIFLUOROMETHYL)CARBINOL(1R)-1-Phenyl-2,2,2-trifluoroethanol(1R)-2,2,2-Trifluoro-1-phenylethanol(R)-2,2,2-trifluoro-1-phenylethan-1-ol(αR)-α-(Trifluoromethyl)benzenemethanol(R)-(-)-2,2,2-TRIFLUORO-1-PHENYLETHANOL(R)-(-)-1-PHENYL-2,2,2-TRIFLUOROETHANOL(r)-(-)-α-(trifluoromethyl)benzyl alcohol(R)-(-)-α-(Trifluoromethyl)benzyl Alcohol(R)-2,2,2-Trifluoro-1-phenylethanol,99%e.e.

Database identifiers

CAS
10531-50-7
PubChem CID
1472402
DTXSID
DTXSID50909418
EC Number
234-094-1
Nikkaji
J56.833C

Properties

Physicochemical properties

Melting point
20 °C · 20 °C(lit.)
Boiling point
99 °C/17 · 99 °C/17 mmHg
Density
1.3 · 1.30
refractive index
1.46 · 1.46
Flash point
87 °C · 87 °C
storage temp.
Keep in dark place,Inert atmosphere,Room temperature
form
clear liquid
pka
11.91 · 11.91±0.10(Predicted)
color
Colorless to Almost colorless
optical activity
-32.968 ° · -32.968°(C=0.01gml DCM)
CAS DataBase Reference
10531 · 10531-50-7(CAS DataBase Reference)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338
Hazard Codes
Xi,C
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
RIDADR
1993 · NA 1993 / PGIII
WGK Germany
3 · 3
F
10 · 10-23
HS Code
29062990 · 29062990

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

F
10-23
wgk
3
ridadr
NA 1993 / PGIII
hs_code
29062990
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi,C
safety_code
26-36
Hazard statements
H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Applications

Uses(R)-2,2,2-Trifluoro-1-phenylethanol is a building block used in the synthesis of mesoporous metal-organic frameworks.

Upstream & downstream products

Upstream raw materials

Benzene, [2,2,2-trifluoro-1-[(trimethylsilyl)oxy]ethyl]-4,4,4-trifluoro-3-hydroxy-1,3-diphenyl-1-butanone(S)-(-)-1-Phenylethanol(S)-(+)-alpha-(Trifluoromethyl)benzyl alcoholTrifluoroacetophenone(S)-(+)-Methyl mandelate(R)-(-)-Methyl mandelateBenzaldehyde

Downstream products

(R)-(+)-1-Phenyl-1-propanol

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