ChemicalBook--->CAS DataBase List--->25597-16-4

25597-16-4

25597-16-4 Structure

25597-16-4 Structure
IdentificationMore
[Name]

Ethyl 4,4,4-trifluorocrotonate
[CAS]

25597-16-4
[Synonyms]

4.4.4-TRIFLUOROCROTONIC ACID ETHYL ESTER
ETHYL 4,4,4-TRIFLUOROCROTONATE
ETHYL 4,4,4-TRIFLUORO-TRANS-2-BUTENOATE
Ethyl (2E)-4,4,4-trifluoro-2-butenoate
Ethyl 4,4,4-trifluorocrotonate 98%
Ethyl4,4,4-trifluorocrotonate98%
2-Butenoic acid, 4,4,4-trifluoro-, ethyl ester, (2E)-
4,4,4-trifluorocrotonate
Ethyl (E)-4,4,4-trifluorobut-2-enoate
[EINECS(EC#)]

607-752-4
[Molecular Formula]

C6H7F3O2
[MDL Number]

MFCD00009903
[Molecular Weight]

168.11
[MOL File]

25597-16-4.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless liquid
[Boiling point ]

114-115 °C(lit.)
[density ]

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

n20/D 1.3601(lit.)
[Fp ]

78 °F
[storage temp. ]

Flammables area
[form ]

Liquid
[color ]

Clear colorless
[Specific Gravity]

1.125
[BRN ]

1707262
[InChI]

InChI=1S/C6H7F3O2/c1-2-11-5(10)3-4-6(7,8)9/h3-4H,2H2,1H3/b4-3+
[InChIKey]

ZKRJCMKLCDWROR-ONEGZZNKSA-N
[SMILES]

C(OCC)(=O)/C=C/C(F)(F)F
[CAS DataBase Reference]

25597-16-4(CAS DataBase Reference)
[NIST Chemistry Reference]

Ethyl 4,4,4-trifluorocrotonate(25597-16-4)
Safety DataBack Directory
[Hazard Codes ]

Xi,F
[Risk Statements ]

R10:Flammable.
R36/37:Irritating to eyes and respiratory system .
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S16:Keep away from sources of ignition-No smoking .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S27:Take off immediately all contaminated clothing .
S28:After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S37/39:Wear suitable gloves and eye/face protection .
[RIDADR ]

UN 3272 3/PG 3
[WGK Germany ]

3
[Hazard Note ]

Flammable
[HazardClass ]

3
[PackingGroup ]

III
[HS Code ]

29161900
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Ethyl 4,4,4-trifluorocrotonate(25597-16-4).msds
Hazard InformationBack Directory
[Chemical Properties]

clear colorless liquid
[Uses]

Ethyl trans-4,4,4-Trifluorocrotonate, is an intermediate used in the synthesis of various pharmaceutically active molecules and agricultural products. It can also be used in the synthesis of novel amino trifluoromethyl cyclopropane carboxylic acid derivatives in the presence of nucleophilic reagents.
Spectrum DetailBack Directory
[Spectrum Detail]

Ethyl 4,4,4-trifluorocrotonate(25597-16-4)MS
Ethyl 4,4,4-trifluorocrotonate(25597-16-4)1HNMR
Ethyl 4,4,4-trifluorocrotonate(25597-16-4)13CNMR
Ethyl 4,4,4-trifluorocrotonate(25597-16-4)IR1
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Ethyl 4,4,4-trifluorocrotonate, 98%(25597-16-4)
[Alfa Aesar]

Ethyl 4,4,4-trifluorocrotonate, 98%(25597-16-4)
[Sigma Aldrich]

25597-16-4(sigmaaldrich)
[TCI AMERICA]

Ethyl 4,4,4-Trifluorocrotonate,>98.0%(GC)(25597-16-4)
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