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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Reference substances

Reference substances

IUPAC name:
3-(trifluoromethyl)phenol

Inventory

EC number:
202-645-5
EC name:
α,α,α-trifluoro-m-cresol
CAS number:
98-17-9
CAS number:
98-17-9
Synonyms
Names:
Phenol, 3-(trifluoromethyl)-
alpha, alpha, alpha-trifluoro-m-cresol
alpha, alpha, alpha-trifluoro-m-cresol; phenol, 3-(trifluoromethyl)-
alpha,alpha,alpha-trifluoro-m-cresol
phenol, 3-(trifluoromethyl)-
Identifier:
other: InChl
1S/C7H5F3O/c8-7(9,10)5-2-1-3-6(11)4-5/h1-4,11H
Identifier:
other: InChl
InChI=1/C7H5F3O/c8-7(9,10)5-2-1-3-6(11)4-5/h1-4,11H
Identifier:
other: SMILES notation
c1cc(cc(c1)O)C(F)(F)F
3-(trifluoromethyl)phenol

Molecular and structural information

Molecular formula:
C7H5F3O
Molecular weight:
162.109
SMILES notation:
Oc1cccc(c1)C(F)(F)F
InChl:
InChI=1/C7H5F3O/c8-7(9,10)5-2-1-3-6(11)4-5/h1-4,11H
Structural formula:
Chemical structure

Related substances

Identifier:
EC number
Identity:
202-645-5