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Heptafluoro-n-propyl bromide

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Name

Heptafluoro-n-propyl bromide

EINECS 207-023-7
CAS No. 422-85-5 Density 1.921 g/cm3
PSA 0.00000 LogP 3.17170
Solubility N/A Melting Point N/A
Formula C3BrF7 Boiling Point 16.8 °C at 760 mmHg
Molecular Weight 248.926 Flash Point N/A
Transport Information UN 3163 Appearance N/A
Safety 23-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 422-85-5 (Heptafluoro-n-propyl bromide) Hazard Symbols IrritantXi
Synonyms

Propane,1-bromoheptafluoro- (6CI,7CI,8CI);1-Bromoheptafluoropropane;1-Bromoperfluoropropane;Heptafluoropropyl bromide;Perfluoropropyl bromide;

Article Data 22

Heptafluoro-n-propyl bromide Specification

The Heptafluoro-n-propyl bromide, with the CAS registry number of 422-85-5, is also known as n-Heptafluoropropyl bromide. Its EINECS registry number is 207-023-7. This chemical's molecular formula is C3BrF7 and molecular weight is 248.9249. What's more, its IUPAC name is 1-Bromo-1, 1, 2, 2, 3, 3, 3-heptafluoropropane.

Physical properties about Heptafluoro-n-propyl bromide are: (1)ACD/LogP: 3.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.93; (4)ACD/LogD (pH 7.4): 3.93; (5)ACD/BCF (pH 5.5): 575.48; (6)ACD/BCF (pH 7.4): 575.48; (7)ACD/KOC (pH 5.5): 3290.26; (8)ACD/KOC (pH 7.4): 3290.26; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.306; (14)Molar Refractivity: 24.72 cm3; (15)Molar Volume: 129.5 cm3; (16)Surface Tension: 15.1 dyne/cm; (17)Density: 1.921 g/cm3; (18)Enthalpy of Vaporization: 25.31 kJ/mol; (19)Boiling Point: 16.8 °C at 760 mmHg; (20)Vapour Pressure: 1020 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. In addition, this chemical may cause inflammation to the skin or other mucous membranes. During using it, wear suitable protective clothing. 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(Br)(F)F
(2) InChI: InChI=1/C3BrF7/c4-2(7,8)1(5,6)3(9,10)11
(3) InChIKey: LANNRYWUUQMNPF-UHFFFAOYAQ

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