The 2-Propenoic acid,2-fluoro-, 2,2,3,3-tetrafluoropropyl ester is an organic compound with the formula C6H5F5O2. The IUPAC name of this chemical is 2,2,3,3-tetrafluoropropyl 2-fluoroprop-2-enoate. With the CAS registry number 96250-37-2, it is also named as Monomer FN-1. The product's category is Monomer.
The other characteristics of 2-Propenoic acid,2-fluoro-, 2,2,3,3-tetrafluoropropyl ester can be summarized as: (1)ACD/LogP: 1.37; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.37; (4)ACD/LogD (pH 7.4): 1.37; (5)ACD/BCF (pH 5.5): 6.44; (6)ACD/BCF (pH 7.4): 6.44; (7)ACD/KOC (pH 5.5): 132.08; (8)ACD/KOC (pH 7.4): 132.08; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Index of Refraction: 1.336; (13)Molar Refractivity: 31.93 cm3; (14)Molar Volume: 153.6 cm3; (15)Polarizability: 12.65×10-24 cm3; (16)Surface Tension: 19 dyne/cm; (17)Enthalpy of Vaporization: 38.22 kJ/mol; (18)Vapour Pressure: 4.93 mmHg at 25°C; (19)Rotatable Bond Count: 5; (20)Exact Mass: 204.02097; (21)MonoIsotopic Mass: 204.02097; (22)Topological Polar Surface Area: 26.3; (23)Heavy Atom Count: 13; (24)Complexity: 213.
People can use the following data to convert to the molecule structure.
1. SMILES:FC(F)(COC(=O)C(\F)=C)C(F)F
2. InChI:InChI=1/C6H5F5O2/c1-3(7)4(12)13-2-6(10,11)5(8)9/h5H,1-2H2
3. InChIKey:OOPSTBSKXWPLKJ-UHFFFAOYAG
4. Std. InChI:InChI=1S/C6H5F5O2/c1-3(7)4(12)13-2-6(10,11)5(8)9/h5H,1-2H2
5. Std. InChIKey:OOPSTBSKXWPLKJ-UHFFFAOYSA-N
The following are the toxicity data which has been tested.
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | oral | 40mg/kg (40mg/kg) | BEHAVIORAL: ATAXIA LUNGS, THORAX, OR RESPIRATION: DYSPNEA BLOOD: HEMORRHAGE | Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 35(2), Pg. 42, 1991. |
rat | LD50 | oral | 60mg/kg (60mg/kg) | BEHAVIORAL: ATAXIA LUNGS, THORAX, OR RESPIRATION: DYSPNEA BLOOD: HEMORRHAGE | Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 35(2), Pg. 42, 1991. |
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View