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2-Propenoic acid,1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl ester

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Name

2-Propenoic acid,1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl ester

EINECS 235-943-9
CAS No. 13057-08-4 Density 1.46 g/cm3
PSA 26.30000 LogP 2.50600
Solubility N/A Melting Point N/A
Formula C6H3F7O2 Boiling Point 100 °C at 760 mmHg
Molecular Weight 240.077 Flash Point 15 °C
Transport Information N/A Appearance N/A
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 13057-08-4 (HEPTAFLUOROISOPROPYL ACRYLATE) Hazard Symbols IrritantXi,FlammableF
Synonyms

Heptafluoroisopropyl acrylate;

 

2-Propenoic acid,1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl ester Specification

The 2-Propenoic acid,1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl ester, with the CAS registry number of 13057-08-4, is also known as Heptafluoroisopropyl acrylate. It belongs to the product category of Monomer. Its EINECS registry number is 235-943-9. Its molecular formula is C6H3F7O2 and molecular weight is 240.08. What's more, its IUPAC name is 1,1,1,2,3,3,3-Heptafluoropropan-2-yl prop-2-enoate.

Physical properties about the 2-Propenoic acid,1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl ester are: (1)ACD/LogP: 3.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.11; (4)ACD/LogD (pH 7.4): 3.11; (5)ACD/BCF (pH 5.5): 135; (6)ACD/BCF (pH 7.4): 135; (7)ACD/KOC (pH 5.5): 1165.48; (8)ACD/KOC (pH 7.4): 1165.48; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.317; (14)Molar Refractivity: 32.38 cm3; (15)Molar Volume: 164.4 cm3; (16)Surface Tension: 17.5 dyne/cm; (17)Density: 1.46 g/cm3; (18)Flash Point: 15 °C; (19)Enthalpy of Vaporization: 33.93 kJ/mol; (20)Boiling Point: 100 °C at 760 mmHg; (21)Vapour Pressure: 37.4 mmHg at 25 °C.

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

You can still convert the following datas into molecular structure:
(1) SMILES: FC(F)(F)C(F)(OC(=O)\C=C)C(F)(F)F
(2) InChI: InChI=1/C6H3F7O2/c1-2-3(14)15-4(7,5(8,9)10)6(11,12)13/h2H,1H2
(3) InChIKey: JTCVKNUSIGHJRG-UHFFFAOYAI

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