2,2-Propanediol,1-chloro-1,1,3,3,3-pentafluoro- supplier

Name
CHLOROPENTAFLUOROACETONE, MONOHYDRATE
EINECS
CAS No. 2036-62-6
Density 1.792 g/cm³
Solubility
Melting Point 26-26,5°C
Formula C₃H₂ClF₅O₂
Boiling Point 196.7 °C at 760 mmHg
Molecular Weight 200.493
Flash Point 72.7 °C
Transport Information
Appearance
Safety 36/37/39-45
Risk Codes 23/24/25
Molecular Structure
Hazard Symbols T
Synonyms Nur alternativ F01979 Chloropentafluoroacetone monohydrate;CHLOROPENTAFLUOROACETONE 1-HYDRATE;Chloropentafluoroacetone monohydrate 97%;Chloropentafluoroacetonemonohydrate97%
PSA 26.30000
LogP 1.88510

2,2-Propanediol,1-chloro-1,1,3,3,3-pentafluoro- Specification

The CAS registry number of 2,2-Propanediol,1-chloro-1,1,3,3,3-pentafluoro- is 2036-62-6. This chemical's molecular formula is C₃H₂ClF₅O₂ and molecular weight is 200.4918. Its systematic name is called 1-chloro-1,1,3,3,3-pentafluoropropane-2,2-diol.

Physical properties about this chemical are: (1)ACD/LogP: 4.10; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.09; (4)ACD/LogD (pH 7.4): 3.67; (5)ACD/BCF (pH 5.5): 747.96; (6)ACD/BCF (pH 7.4): 286.48; (7)ACD/KOC (pH 5.5): 3946.04; (8)ACD/KOC (pH 7.4): 1511.37; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Index of Refraction: 1.358; (13)Molar Refractivity: 24.58 cm³; (14)Molar Volume: 111.8 cm³; (15)Surface Tension: 27.5 dyne/cm; (16)Density: 1.792 g/cm³; (17)Enthalpy of Vaporization: 50.37 kJ/mol; (18)apour Pressure: 0.101 mmHg at 25°C; (19)Boiling Point: 196.7 ° at 760 mmHg; (20)Flash Point: 72.7 °C.

When you are using this chemical, please be cautious about it as the following:
This chemical is toxic by inhalation, in contact with skin and if swallowed. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: ClC(F)(F)C(O)(O)C(F)(F)F
(2)InChI: InChI=1/C3H2ClF5O2/c4-2(5,6)1(10,11)3(7,8)9/h10-11H
(3)InChIKey: KODPWAQOSRGQFM-UHFFFAOYAJ

Product Name

CHLOROPENTAFLUOROACETONE, MONOHYDRATE

2,2-Propanediol,1-chloro-1,1,3,3,3-pentafluoro- Specification

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