ChemicalBook--->CAS DataBase List--->447-61-0

447-61-0

447-61-0 Structure

447-61-0 Structure
IdentificationMore
[Name]

2-(Trifluoromethyl)benzaldehyde
[CAS]

447-61-0
[Synonyms]

2-(TRIFLUOROMETHYL)BENZALDEHYDE
A,A,A-TRIFLUORO-O-TOLUALDEHYDE
AKOS BBS-00003172
ALPHA,ALPHA,ALPHA-TRIFLUORO-O-TOLUALDEHYDE
BENZOTRIFLUORIDE-2-CARBALDEHYDE
ORTHO-TRIFLUOROMETHYL-BENZALDEHYDE
OTF-BAD
O-(TRIFLUOROMETHYL)BENZALDEHYDE
o-Tolualdehyde, alpha,alpha,alpha-trifluoro-
à,à,à-trifluoro-o-tolualdehyde
α,α,α-trifluoro-o-tolualdehyde
2-(Trifluoromethyl)benzaldehyde 98%
2-(Trifluoromethyl)benzaldehyde98%
2-Trifluormethylbenzaldehyde
[EINECS(EC#)]

207-185-9
[Molecular Formula]

C8H5F3O
[MDL Number]

MFCD00003337
[Molecular Weight]

174.12
[MOL File]

447-61-0.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless to slightly yellow liquid
[Melting point ]

-40 °C
[Boiling point ]

70-71 °C (16 mmHg)
[density ]

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

n20/D 1.466(lit.)
[Fp ]

142 °F
[storage temp. ]

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

Soluble in most organic solvents.
[form ]

Liquid
[color ]

Clear colorless to slightly yellow
[Specific Gravity]

1.320
[Sensitive ]

Air Sensitive
[Detection Methods]

GC,NMR
[BRN ]

2045512
[InChI]

1S/C8H5F3O/c9-8(10,11)7-4-2-1-3-6(7)5-12/h1-5H
[InChIKey]

ZDVRPKUWYQVVDX-UHFFFAOYSA-N
[SMILES]

FC(F)(F)c1ccccc1C=O
[LogP]

2.67
[CAS DataBase Reference]

447-61-0(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzaldehyde, 2-(trifluoromethyl)-(447-61-0)
[Storage Precautions]

Store under nitrogen
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

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

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S37/39:Wear suitable gloves and eye/face protection .
S36:Wear suitable protective clothing .
[RIDADR ]

UN 1993 3/PG III
[WGK Germany ]

3
[Hazard Note ]

Irritant
[REACH Registrations]

Inactive
[HazardClass ]

IRRITANT
[PackingGroup ]

III
[HS Code ]

29130000
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Raw materials And Preparation ProductsBack Directory
[Raw materials]

1,3-Dioxolane, 2-[2-(trifluoromethyl)phenyl]--->2-Iodobenzotrifluoride-->7H-DODECAFLUOROHEPTANAL-->2-(TRIFLUOROMETHYL)STYRENE-->2-(TRIFLUOROMETHYL)BENZAL CHLORIDE-->alpha,alpha,alpha,alpha',alpha'-pentafluoro-o-xylene-->2-(Trifluoromethyl)benzyl alcohol-->2-(Trifluoromethyl)benzoyl chloride-->2-Bromobenzotrifluoride
[Preparation Products]

2-(Trifluoromethyl)phenylacetic acid-->METHYL-(2-TRIFLUOROMETHYL-BENZYL)-AMINE-->Methyl 2-(trifluoromethyl)benzoate-->2-(TRIFLUOROMETHYL)BENZYLAMINE-->3-[o-(alpha,alpha,alpha-trifluorotolyl)]propionic acid-->Benzotrifluoride-->2-(2-trifluoroMethylphenyl)iMidazole[4,5f][1,10]phenanthroline
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

alpha,alpha,alpha-Trifluoro-o-tolualdehyde(447-61-0).msds
Hazard InformationBack Directory
[Chemical Properties]

clear colorless to slightly yellow liquid
[Uses]

2-(Trifluoromethyl)benzaldehyde has been used in the preparation of ω-(dimethylamino)-alkylethyl-4(-2-(trifluorormethyl)phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylates, methyl (E)-2-[2-[(E)-2-(2-trifluoromethylphenyl)vinyl]-phenyl]-3-methoxyacrylate via Wittig-Horner reaction. It is a reagent used as electrophilic component in a wide array of reactions.
[Synthesis Reference(s)]

Tetrahedron, 49, p. 2151, 1993 DOI: 10.1016/S0040-4020(01)80359-8
Spectrum DetailBack Directory
[Spectrum Detail]

2-(Trifluoromethyl)benzaldehyde(447-61-0)MS
2-(Trifluoromethyl)benzaldehyde(447-61-0)1HNMR
2-(Trifluoromethyl)benzaldehyde(447-61-0)IR1
2-(Trifluoromethyl)benzaldehyde(447-61-0)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-(Trifluoromethyl)benzaldehyde, 97%(447-61-0)
[Alfa Aesar]

2-(Trifluoromethyl)benzaldehyde, 98%(447-61-0)
[Sigma Aldrich]

447-61-0(sigmaaldrich)
[TCI AMERICA]

2-(Trifluoromethyl)benzaldehyde,>95.0%(GC)(447-61-0)
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