Ethane,1,1,1,2,2-pentabromo- supplier

Name
PENTABROMOETHANE
EINECS 200-918-3
CAS No. 75-95-6
Article Data15
CAS DataBase
Density 3.319 g/cm³
Solubility
Melting Point 55 °C
Formula C₂HBr₅
Boiling Point 277.8 °C at 760 mmHg
Molecular Weight 424.55
Flash Point 120.3 °C
Transport Information UN 2811
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xn
Synonyms Ethane,pentabromo- (6CI,7CI,8CI,9CI);1,1,1,2,2-Pentabromoethane;Pentabromoethane;
PSA 0.00000
LogP 3.94080

Ethane,1,1,1,2,2-pentabromo- Specification

The Ethane, 1, 1, 1, 2, 2-pentabromo-, with the CAS registry number of 75-95-6, is also known as Pentabromoethane. Its EINECS registry number is 200-918-3. This chemical's molecular formula is C₂HBr₅ and molecular weight is 424.55. What's more, its IUPAC name is 1, 1, 1, 2, 2-Pentabromoethane. This chemical's classification code is Tumor Data.

Physical properties about Ethane, 1, 1, 1, 2, 2-pentabromo- are: (1)ACD/LogP: 5.95; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.95; (4)ACD/LogD (pH 7.4): 5.95; (5)ACD/BCF (pH 5.5): 19510.89; (6)ACD/BCF (pH 7.4): 19510.89; (7)ACD/KOC (pH 5.5): 40979.53; (8)ACD/KOC (pH 7.4): 40979.53; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.708; (14)Molar Refractivity: 49.89 cm³; (15)Molar Volume: 127.8 cm³; (16)Surface Tension: 66.2 dyne/cm; (17)Density: 3.319 g/cm³; (18)Flash Point: 120.3 °C; (19)Enthalpy of Vaporization: 49.56 kJ/mol; (20)Boiling Point: 277.8 °C at 760 mmHg; (21)Vapour Pressure: 0.00748 mmHg at 25 °C.

Uses: it is used to produce other chemicals. For example, it is used to produce 1, 1-Dibromo-2-nitro-ethene. The reaction needs reagent 60 % HNO₃. The reaction time is 3 hours with reaction temperature of 50-55 °C. The yield is about 50 %.

You can still convert the following datas into molecular structure:
(1) SMILES: BrC(Br)C(Br)(Br)Br
(2) InChI: InChI=1/C2HBr5/c3-1(4)2(5,6)7/h1H
(3) InChIKey: OGVPXEPSTZMAFF-UHFFFAOYAL

Product Name

PENTABROMOETHANE

Ethane,1,1,1,2,2-pentabromo- Specification

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