2,2',6,6'-Tetrabromobisphenol A diallyl ether supplier

Name
2,2',6,6'-Tetrabromobisphenol A diallyl ether
EINECS 246-850-8
CAS No. 25327-89-3
Density 1.678 g/cm³
Solubility 0.312ng/L
Melting Point 118-120 °C(lit.)
Formula C₂₁H₂₀Br₄O₂
Boiling Point 524.985 °C at 760 mmHg
Molecular Weight 624.005
Flash Point 220.375 °C
Transport Information UN 3152
Appearance
Safety
Risk Codes R3152
Molecular Structure
Hazard Symbols
Synonyms 1,1'-Isopropylidenebis[4-(allyloxy)-3,5-dibromobenzene];2,2-Bis(3,5-dibromo-4-allyloxyphenyl)propane;2,2-Bis(4-allyloxy-3,5-dibromophenyl)propane;BE 51;FG 3200;Fire Guard 3200;Flame Cut 122K;Benzene,1,1'-(1-methylethylidene)bis[3,5-dibromo-4-(2-propenyloxy)- (9CI);Propane, 2,2-bis[4-(allyloxy)-3,5-dibromophenyl]-(8CI);Pyroguard SR 319;SR 319;Tetrabromobisphenol A allyl ether;Tetrabromobisphenol A bis(allyl ether);Tetrabromobisphenol A diallyl ether;
PSA 18.46000
LogP 8.19210

2,2',6,6'-Tetrabromobisphenol A diallyl ether Specification

The 2,2',6,6'-Tetrabromobisphenol A diallyl ether, with the CAS registry number 25327-89-3, is also known as 1,1'-(2,2-Propanediyl)bis[4-(allyloxy)-3,5-dibromobenzene]. It belongs to the product categories of Organics; Allyl Monomers; Monomers; Polymer Science. Its EINECS registry number is 246-850-8. This chemical's molecular formula is C₂₁H₂₀Br₄O₂ and molecular weight is 624.00. What's more, its IUPAC name is called 1,3-Dibromo-5-[2-(3,5-dibromo-4-prop-2-enoxyphenyl)propan-2-yl]-2-prop-2-enoxybenzene. It should be stored in a cool, dry and well-ventilated place. This chemical can be used as intermediates and flame retardant.

Physical properties about 2,2',6,6'-Tetrabromobisphenol A diallyl ether are: (1)ACD/LogP: 11.421; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 11.42; (4)ACD/LogD (pH 7.4): 11.42; (5)ACD/BCF (pH 5.5): 1000000.00; (6)ACD/BCF (pH 7.4): 1000000.00; (7)ACD/KOC (pH 5.5): 10000000.00; (8)ACD/KOC (pH 7.4): 10000000.00; (9)#H bond acceptors: 2 ; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 18.46 Å²; (13)Index of Refraction: 1.596; (14)Molar Refractivity: 126.505 cm³; (15)Molar Volume: 371.663 cm³; (16)Polarizability: 50.15×10^-24 cm³; (17)Surface Tension: 41.308 dyne/cm; (18)Density: 1.679 g/cm³; (19)Flash Point: 220.375 °C; (20)Enthalpy of Vaporization: 76.893 kJ/mol; (21)Boiling Point: 524.985 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Brc1cc(cc(Br)c1OC\C=C)C(c2cc(Br)c(OC\C=C)c(Br)c2)(C)C
(2) InChI: Brc1cc(cc(Br)c1OC\C=C)C(c2cc(Br)c(OC\C=C)c(Br)c2)(C)C
(3) InChIKey: Brc1cc(cc(Br)c1OC\C=C)C(c2cc(Br)c(OC\C=C)c(Br)c2)(C)C

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
rabbit	LD50	skin	> 2gm/kg (2000mg/kg)		National Technical Information Service. Vol. OTS000756-1,
rat	LD50	oral	> 5gm/kg (5000mg/kg)		National Technical Information Service. Vol. OTS000756-1,

Product Name

2,2',6,6'-Tetrabromobisphenol A diallyl ether

2,2',6,6'-Tetrabromobisphenol A diallyl ether Specification

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