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49561-96-8

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49561-96-8 Structure

49561-96-8 Structure

Identification	More
[Name] 4-(TRIFLUOROMETHOXY)PHENYLACETONITRILE
[CAS] 49561-96-8
[Synonyms] 1-[4-(TRIFLUOROMETHOXY)PHENYL]ACETONITRILE 4-TRIFLUOROMETHOXYBENZYL CYANIDE 4-(TRIFLUOROMETHOXY)PHENYLACETONITRILE p-Trifluoromethoxyphenyl acetonitrile 4-(Trifluoromethoxy)phenylacetonitrile 98% 4-(Trifluoromethoxy)phenylacetonitrile98%
[Molecular Formula] C9H6F3NO
[MDL Number] MFCD00061240
[Molecular Weight] 201.15
[MOL File] 49561-96-8.mol

Chemical Properties	Back Directory
[Appearance] clear yellow liquid
[Melting point ] 30-33 °C(lit.)
[Boiling point ] 96°C/4mmHg
[density ] 1.28
[refractive index ] 1.448-1.45
[Fp ] >230 °F
[storage temp. ] Store at room temperature
[form ] Liquid
[color ] Clear yellow
[BRN ] 2643789
[InChI] 1S/C9H6F3NO/c10-9(11,12)14-8-3-1-7(2-4-8)5-6-13/h1-4H,5H2
[InChIKey] LYFCAROXYJTUQF-UHFFFAOYSA-N
[SMILES] FC(F)(F)Oc1ccc(CC#N)cc1
[CAS DataBase Reference] 49561-96-8(CAS DataBase Reference)

Safety Data	Back Directory
[Hazard Codes ] Xn,T,Xi
[Risk Statements ] R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ] S36/37:Wear suitable protective clothing and gloves .
[RIDADR ] 3276
[WGK Germany ] 3
[Hazard Note ] Toxic
[HazardClass ] 6.1
[PackingGroup ] III
[HS Code ] 29269090
[Storage Class] 11 - Combustible Solids
[Hazard Classifications] Acute Tox. 4 Oral

Hazard Information	Back Directory
[Chemical Properties] clear yellow liquid
[Uses] 4-(Trifluoromethoxy)phenylacetonitrile is para-trifluoromethoxy substituted phenylacetonitrile.
[Definition] ChEBI: 4-(Trifluoromethoxy)phenylacetonitrile is a nitrile.
[General Description] 4-(Trifluoromethoxy)phenylacetonitrile is para-trifluoromethoxy substituted phenylacetonitrile.

Spectrum Detail	Back Directory
[Spectrum Detail] 4-(TRIFLUOROMETHOXY)PHENYLACETONITRILE(49561-96-8)MS 4-(TRIFLUOROMETHOXY)PHENYLACETONITRILE(49561-96-8)¹HNMR 4-(TRIFLUOROMETHOXY)PHENYLACETONITRILE(49561-96-8)IR1 4-(TRIFLUOROMETHOXY)PHENYLACETONITRILE(49561-96-8)IR2

Well-known Reagent Company Product Information	Back Directory
[Acros Organics] 4-(Trifluoromethoxy)phenylacetonitrile, 98%(49561-96-8)
[Alfa Aesar] 4-(Trifluoromethoxy)phenylacetonitrile, 98%(49561-96-8)
[Sigma Aldrich] 49561-96-8(sigmaaldrich)
[TCI AMERICA] 4-(Trifluoromethoxy)phenylacetonitrile,>98.0%(GC)(49561-96-8)

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