570391-18-3

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570391-18-3 Structure

Identification	Back Directory
[Name] 3-Chloro-5-hydroxyBenzotrifluoride
[CAS] 570391-18-3
[Synonyms] 3-Chloro-5-hydroxyBenzotrifluoride Phenol, 3-chloro-5-(trifluoromethyl)- 3-Chloro-5-(trifluoromethyl)phenol, 5-Chloro-alpha,alpha,alpha-trifluoro-m-cresol
[Molecular Formula] C7H4ClF3O
[MDL Number] MFCD04115852
[MOL File] 570391-18-3.mol
[Molecular Weight] 196.554

Chemical Properties	Back Directory
[Boiling point ] 204.8±35.0 °C(Predicted)
[density ] 1.47g/ml
[refractive index ] 1.4850
[form ] liquid
[pka] 8.00±0.10(Predicted)
[color ] Clear, light yellow
[InChI] InChI=1S/C7H4ClF3O/c8-5-1-4(7(9,10)11)2-6(12)3-5/h1-3,12H
[InChIKey] BPJWMOPEHPOKFT-UHFFFAOYSA-N
[SMILES] C1(O)=CC(C(F)(F)F)=CC(Cl)=C1
[CAS DataBase Reference] 570391-18-3

Safety Data	Back Directory
[Symbol(GHS) ] GHS05,GHS07
[Signal word ] Danger
[Hazard statements ] H302-H312-H314-H318
[Precautionary statements ] P280-P305+P351+P338-P309-P310
[Hazard Codes ] T
[HazardClass ] 8
[HS Code ] 2933499090

Spectrum Detail	Back Directory
[Spectrum Detail] 3-Chloro-5-hydroxyBenzotrifluoride(570391-18-3)¹HNMR

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