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CAS No.: | 15378-31-1 |
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Name: | 3-broMo-2-(broMoMethy)prop-1-ene |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C4H6Br2 |
Molecular Weight: | 213.9 |
Synonyms: | 3-Bromo-2-(bromomethy)prop-1-ene; |
Density: | 1.847 g/cm3 |
Boiling Point: | 184.314 °C at 760 mmHg |
Flash Point: | 60.786 °C |
Hazard Symbols: | T |
Risk Codes: | 25-41-52/53 |
Safety: | 26-39-45-61 |
Transport Information: | UN 2810 6.1/PG 3 |
PSA: | 0.00000 |
LogP: | 2.33240 |
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The 1-Propene, 3-bromo-2-(bromomethyl)-, with the CAS registry number 15378-31-1, is also known as 3-Bromo-2-(bromomethy)prop-1-ene. It belongs to the product categories of Acyclic; Alkenes; Alkenyl; Building Blocks; Chemical Synthesis; Halogenated Hydrocarbons; Organic Building Blocks. This chemical's molecular formula is C4H6Br2 and molecular weight is 213.90. What's more, its systematic name is called 3-Bromo-2-(bromomethyl)-1-propene.
Physical properties about 1-Propene, 3-bromo-2-(bromomethyl)- are: (1)ACD/LogP: 2.299; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.30; (4)ACD/LogD (pH 7.4): 2.30; (5)ACD/BCF (pH 5.5): 32.90; (6)ACD/BCF (pH 7.4): 32.90; (7)ACD/KOC (pH 5.5): 424.21; (8)ACD/KOC (pH 7.4): 424.21; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12) Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.527; (14) Molar Refractivity: 35.612 cm3; (15)Molar Volume: 115.821 cm3; (16) Polarizability: 14.118×10-24cm3; (17)Surface Tension: 34.528 dyne/cm; (18)Density: 1.847 g/cm3; (19)Flash Point: 60.786 °C; (20)Enthalpy of Vaporization: 40.331 kJ/mol; (21)Boiling Point: 184.314 °C at 760 mmHg; (22)Vapour Pressure: 1.009 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: BrC/C(=C)CBr
(2) InChI: InChI=1S/C4H6Br2/c1-4(2-5)3-6/h1-3H2
(3) InChIKey: BDHXXBPPYQRWMC-UHFFFAOYSA-N