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CAS No.: | 5930-67-6 |
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Name: | DIFLUOROMALONYL FLUORIDE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C3F4O2 |
Molecular Weight: | 144.025 |
Synonyms: | Perfluoromalonyl fluoride;Malonylfluoride, difluoro- (7CI,8CI);Propanedioyl difluoride, difluoro- (9CI);Difluoromalonyl difluoride;Difluoromalonyl fluoride; |
Density: | 1.529 g/cm3 |
Boiling Point: | 101.1 °C at 760 mmHg |
Flash Point: | 29.5 °C |
Hazard Symbols: | C,T |
Risk Codes: | 23-34 |
Safety: | 23-38 |
PSA: | 34.14000 |
LogP: | 0.61390 |
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The CAS registry number of Propanedioyldifluoride, 2,2-difluoro- is 5930-67-6. This chemical is also named as Difluoromalonoyl fluoride. In addition, its molecular formula is C3F4O2 and molecular weight is 144.02. Its systematic name is called difluoropropanedioyl difluoride.
Physical properties about Propanedioyldifluoride, 2,2-difluoro- are:(1)ACD/LogP: 2.31; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.31; (4)ACD/LogD (pH 7.4): 2.31; (5)ACD/BCF (pH 5.5): 33.41; (6)ACD/BCF (pH 7.4): 33.41; (7)ACD/KOC (pH 5.5): 428.97; (8)ACD/KOC (pH 7.4): 428.97; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.282; (13)Molar Refractivity: 16.62 cm3; (14)Molar Volume: 94.1 cm3; (15)Surface Tension: 18.3 dyne/cm; (16)Density: 1.529 g/cm3; (17)Flash Point: 29.5 °C; (18)Enthalpy of Vaporization: 34.04 kJ/mol; (19)Boiling Point: 101.1 °C at 760 mmHg; (20)Vapour Pressure: 35.6 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is toxic if swallowed. It may destroy living tissue on contact and may cause burns. It is toxic by inhalation. Do not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer). In case of insufficient ventilation you should wear suitable respiratory equipment.
You can still convert the following datas into molecular structure:
(1)SMILES: FC(=O)C(F)(F)C(F)=O
(2)InChI: InChI=1/C3F4O2/c4-1(8)3(6,7)2(5)9
(3)InChIKey: KJOOJFLEZNWPIN-UHFFFAOYAD