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Name |
Acetic acid,2,2-difluoro-2-[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethoxy]- |
EINECS | N/A |
CAS No. | 151772-58-6 | Density | 1.765 g/cm3 |
PSA | 55.76000 | LogP | 2.40240 |
Solubility | N/A | Melting Point |
N/A |
Formula | C5HF9O4 | Boiling Point | 185.8 °C at 760 mmHg |
Molecular Weight | 296.046 | Flash Point | 66.2 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36/37/39 | Risk Codes | 34 |
Molecular Structure | Hazard Symbols | Xi,C | |
Synonyms |
Aceticacid, difluoro[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethoxy]- (9CI);Difluoro[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethoxy]acetic acid;Nonafluoro-3,6-dioxaheptanoic acid;Perfluoro-3,6-dioxaheptanoic acid;2,2-Difluoro-2-[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethoxy]acetic acid; |
The Acetic acid,2,2-difluoro-2-[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethoxy]-, with the CAS registry number 151772-58-6, is also known as Difluoro[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethoxy]acetic acid. This chemical's molecular formula is C5HF9O4 and molecular weight is 296.04. What's more, its systematic name is 2,2-difluoro-2-[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethoxy]acetic acid.
Physical properties of Acetic acid,2,2-difluoro-2-[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethoxy]- are: (1)ACD/LogP: 7.69; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 3.96; (4)ACD/LogD (pH 7.4): 3.94; (5)ACD/BCF (pH 5.5): 77.23; (6)ACD/BCF (pH 7.4): 73.44; (7)ACD/KOC (pH 5.5): 68.14; (8)ACD/KOC (pH 7.4): 64.79; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 44.76 Å2; (13)Index of Refraction: 1.302; (14)Molar Refractivity: 31.6 cm3; (15)Molar Volume: 167.6 cm3; (16)Polarizability: 12.52×10-24cm3; (17)Surface Tension: 20.8 dyne/cm; (18)Density: 1.765 g/cm3; (19)Flash Point: 66.2 °C; (20)Enthalpy of Vaporization: 46.52 kJ/mol; (21)Boiling Point: 185.8 °C at 760 mmHg; (22)Vapour Pressure: 0.31 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
It can cause burns. 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)Canonical SMILES: C(=O)(C(OC(C(OC(F)(F)F)(F)F)(F)F)(F)F)O
(2)InChI: InChI=1S/C5HF9O4/c6-2(7,1(15)16)17-3(8,9)4(10,11)18-5(12,13)14/h(H,15,16)
(3)InChIKey: PPWRLPJIHGWGFH-UHFFFAOYSA-N