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tert-Butyl2-(trifluoromethyl)acrylate

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Name

tert-Butyl2-(trifluoromethyl)acrylate

EINECS N/A
CAS No. 105935-24-8 Density 1.118 g/cm3
PSA 26.30000 LogP 2.44660
Solubility N/A Melting Point N/A
Formula C8H11F3O2 Boiling Point 174.2 °C at 760 mmHg
Molecular Weight 196.169 Flash Point 37.2 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 105935-24-8 (T-BUTYL 2-(TRIFLUOROMETHYL)ACRYLATE) Hazard Symbols IrritantXi
Synonyms

tert-Butyl alpha-trifluoromethylacrylate;tert-Butyl2-trifluoromethylacrylate;2-Methyl-2-propanyl 2-(trifluoromethyl)acrylate;

 

tert-Butyl2-(trifluoromethyl)acrylate Specification

The 2-Propenoic acid,2-(trifluoromethyl)-, 1,1-dimethylethyl ester, with the CAS registry number 105935-24-8, is also known as 2-Methyl-2-propanyl 2-(trifluoromethyl)acrylate. It belongs to the product category of Monomer. This chemical's molecular formula is C8H11F3O2 and molecular weight is 196.17. What's more, its systematic name is tert-butyl 2-(trifluoromethyl)prop-2-enoate. 

Physical properties of 2-Propenoic acid,2-(trifluoromethyl)-, 1,1-dimethylethyl ester are: (1)ACD/LogP: 3.89; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.89; (4)ACD/BCF (pH 5.5): 529.63; (5)ACD/KOC (pH 5.5): 3100.43; (6)#H bond acceptors: 2; (7)#H bond donors: 0; (8)#Freely Rotating Bonds: 3; (9)Polar Surface Area: 26.3 Å2; (10)Index of Refraction: 1.382; (11)Molar Refractivity: 40.87 cm3; (12)Molar Volume: 175.4 cm3; (13)Surface Tension: 21.8 dyne/cm; (14)Density: 1.118 g/cm3; (15)Flash Point: 37.2 °C; (16)Enthalpy of Vaporization: 41.06 kJ/mol; (17)Boiling Point: 174.2 °C at 760 mmHg; (18)Vapour Pressure: 1.22 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(C)(C)C)/C(=C)C(F)(F)F
(2)InChI: InChI=1S/C8H11F3O2/c1-5(8(9,10)11)6(12)13-7(2,3)4/h1H2,2-4H3
(3)InChIKey: RCSSZBOUAGQERK-UHFFFAOYSA-N

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