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ChemicalBook--->CAS DataBase List--->401-95-6

401-95-6

401-95-6 Structure

401-95-6 Structure
IdentificationMore
[Name]

3,5-Bis(trifluoromethyl)benzaldehyde
[CAS]

401-95-6
[Synonyms]

3,5-BIS(TRIFLUOROMETHYL)BENZALDEHYDE
3,5-DI(TRIFLUOROMETHYL)BENZALDEHYDE
MBT-BAD
TIMTEC-BB SBB006661
3,5-diCF3-benzaldehyde radical
3,5-BIS(TRIFLUOROMETHYL)BENZALDEHYDE, 97 %
3,5-Bis(trifluoromethyl)benzaldehyde 98%
3,5-BSI(TRIFLUOROMETHYL)BENZALDEHYDE
3,5-Bis(trifluoromethyl)benzaldehyde98%
TRIFLUOROMETHYL BENZALDEHYDE
[EINECS(EC#)]

202-860-4
[Molecular Formula]

C9H4F6O
[MDL Number]

MFCD00010206
[Molecular Weight]

242.12
[MOL File]

401-95-6.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless to yellow liquid
[Boiling point ]

37 °C1.3 mm Hg(lit.)
[density ]

1.469 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.422(lit.)
[Fp ]

158 °F
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[form ]

Liquid
[color ]

Clear colorless to yellow
[Specific Gravity]

1.469
[Water Solubility ]

Insoluble in water. Soluble in many organic solvents.
[Sensitive ]

Air Sensitive
[BRN ]

1884058
[InChI]

InChI=1S/C9H4F6O/c10-8(11,12)6-1-5(4-16)2-7(3-6)9(13,14)15/h1-4H
[InChIKey]

LDWLIXZSDPXYDR-UHFFFAOYSA-N
[SMILES]

C(=O)C1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1
[CAS DataBase Reference]

401-95-6(CAS DataBase Reference)
[NIST Chemistry Reference]

3,5-Bis(trifluoromethyl)benzaldehyde(401-95-6)
Safety DataBack Directory
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R22:Harmful if swallowed.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[F ]

10-21
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29124990
Raw materials And Preparation ProductsBack Directory
[Raw materials]

3,5-Bis(trifluoromethyl)benzyl alcohol-->3,5-Bis(trifluoromethyl)benzoic acid
[Preparation Products]

3,5-Bis(trifluoromethyl)benzylamine-->(S)-1-[3,5-Bis(trifluoromethyl)phenyl]ethanol-->(3,5-BIS(TRIFLUOROMETHYL)PHENYL)(PHENYL)METHANOL-->3,5-BIS(TRIFLUORO-METHYL)CINNAMIC ETHYL ESTER
Hazard InformationBack Directory
[Chemical Properties]

clear colorless to yellow liquid
[Uses]

3,5-Bis(trifluoromethyl)benzaldehyde was used in the synthesis of a series of meso-3,5-bis(trifluoromethyl)phenyl-substituted expanded porphyrins.
Spectrum DetailBack Directory
[Spectrum Detail]

3,5-Bis(trifluoromethyl)benzaldehyde(401-95-6)MS
3,5-Bis(trifluoromethyl)benzaldehyde(401-95-6)1HNMR
3,5-Bis(trifluoromethyl)benzaldehyde(401-95-6)13CNMR
3,5-Bis(trifluoromethyl)benzaldehyde(401-95-6)IR1
3,5-Bis(trifluoromethyl)benzaldehyde(401-95-6)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3,5-Bis(trifluoromethyl)benzaldehyde, 97%(401-95-6)
[Alfa Aesar]

3,5-Bis(trifluoromethyl)benzaldehyde, 97%(401-95-6)
[Sigma Aldrich]

401-95-6(sigmaaldrich)
[TCI AMERICA]

3,5-Bis(trifluoromethyl)benzaldehyde,>95.0%(GC)(401-95-6)
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