CAS No.422-59-3,Pentafluoropropionyl chloride Suppliers

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Basic Information

Molecular Structure:
CAS No.:	422-59-3
Name:	Pentafluoropropionyl chloride
Article Data:	12

Formula:	C₃ClF₅O
Molecular Weight:	182.477
Synonyms:	Propanoylchloride, pentafluoro- (9CI);Propionyl chloride, pentafluoro- (6CI,8CI);Pentafluoropropionyl chloride;Perfluoropropionic chloride;Perfluoropropionylchloride;
EINECS:	207-017-4
Density:	1.602 g/cm³
Boiling Point:	13.7 °C at 760 mmHg
Flash Point:	-38℃
Hazard Symbols:	C
Risk Codes:	34
Safety:	23-26-36/37/39
Transport Information:	UN 3308
PSA:	17.07000
LogP:	1.94940

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Specification

The Propanoyl chloride, 2, 2, 3, 3, 3-pentafluoro-, with the CAS registry number of 422-59-3, is also known as Perfluoropropionic chloride. Its EINECS registry number is 207-017-4. This chemical's molecular formula is C₃ClF₅O and molecular weight is 182.48. What's more, its IUPAC name is 2, 2, 3, 3, 3-Pentafluoropropanoyl chloride.

Physical properties about Propanoyl chloride, 2, 2, 3, 3, 3-pentafluoro- are: (1)ACD/LogP: 3.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.52; (4)ACD/LogD (pH 7.4): 3.52; (5)ACD/BCF (pH 5.5): 276.82; (6)ACD/BCF (pH 7.4): 276.82; (7)ACD/KOC (pH 5.5): 1948.65; (8)ACD/KOC (pH 7.4): 1948.65; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.304; (14)Molar Refractivity: 21.57 cm³; (15)Molar Volume: 113.8 cm³; (16)Surface Tension: 17.4 dyne/cm; (17)Density: 1.602 g/cm³; (18)Enthalpy of Vaporization: 26.13 kJ/mol; (19)Boiling Point: 13.7 °C at 760 mmHg; (20)Vapour Pressure: 1150 mmHg at 25 °C.

Uses of Propanoyl chloride, 2, 2, 3, 3, 3-pentafluoro-: it is used to produce other chemicals. For example, it is used to produce 2, 2, 2-Trifluoroethyl 2, 2, 3, 3, 3-pentafluoropropionate. The reaction needs reagent Pyridine and solvent Bis-(2-methoxy-ethyl) ether. The reaction time is 1 hour with reaction temperature of 25 °C. The yield is about 79 %.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause burns on contact. In addition, the vapour of this chemical can not be breathed. During using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: FC(F)(F)C(F)(F)C(Cl)=O
(2) InChI: InChI=1/C3ClF5O/c4-1(10)2(5,6)3(7,8)9
(3) InChIKey: SHMNLEQWIMKCQA-UHFFFAOYAY