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Basic Information
CAS No.: 30432-16-7
Name: 1,4-DIBROMO-2,3-BIS(BROMOMETHYL)-2-BUTENE
Molecular Structure:
Molecular Structure of 30432-16-7 (1,4-DIBROMO-2,3-BIS(BROMOMETHYL)-2-BUTENE)
Formula: C6H8Br4
Molecular Weight: 399.746
Synonyms: 1,4-Dibromo-2,3-bis(bromomethyl)-2-butene;Tetra(bromomethyl)ethene;Tetrakis(bromomethyl)ethylene;
Density: 2.303 g/cm3
Melting Point: 158-159 °C(Solv: cyclohexane (110-82-7))
Boiling Point: 376.9 °C at 760 mmHg
Flash Point: 176.6 °C
PSA: 0.00000
LogP: 3.86260
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    Tetra(bromomethyl)ethene

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  • 1,4-DIBROMO-2,3-BIS(BROMOMETHYL)-2-BUTENE

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    1,4-DIBROMO-2,3-BIS(BROMOMETHYL)-2-BUTENE

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Specification

The 2-Butene,1,4-dibromo-2,3-bis(bromomethyl)-, with the CAS registry number 30432-16-7, is also known as 2,3-Bis (bromomethyl)-1,4-dibromo-2-butene. This chemical's molecular formula is C6H8Br4 and molecular weight is 399.74372. Its IUPAC name is called 1,4-dibromo-2,3-bis(bromomethyl)but-2-ene.

Physical properties of 2-Butene,1,4-dibromo-2,3-bis(bromomethyl)-: (1)ACD/LogP: 4.81; (2)ACD/LogD (pH 5.5): 4.81; (3)ACD/LogD (pH 7.4): 4.81; (4)ACD/BCF (pH 5.5): 2670.42; (5)ACD/BCF (pH 7.4): 2670.42; (6)ACD/KOC (pH 5.5): 9870.53; (7)ACD/KOC (pH 7.4): 9870.53; (8)#Freely Rotating Bonds: 4; (9)Index of Refraction: 1.614; (10)Molar Refractivity: 60.51 cm3; (11)Molar Volume: 173.5 cm3; (12)Surface Tension: 48.9 dyne/cm; (13)Density: 2.303 g/cm3; (14)Flash Point: 176.6 °C; (15)Enthalpy of Vaporization: 60.01 kJ/mol; (16)Boiling Point: 376.9 °C at 760 mmHg; (17)Vapour Pressure: 1.52E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C(C(=C(CBr)CBr)CBr)Br
(2)InChI: InChI=1S/C6H8Br4/c7-1-5(2-8)6(3-9)4-10/h1-4H2
(3)InChIKey: GJZKNORRVIUCCH-UHFFFAOYSA-N

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 18mg/kg (18mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04534,