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4162-45-2

Basic Information
CAS No.: 4162-45-2
Name: 4,4'-Isopropylidenebis[2-(2,6-dibromophenoxy)ethanol]
Molecular Structure:
Molecular Structure of 4162-45-2 (4,4'-Isopropylidenebis[2-(2,6-dibromophenoxy)ethanol])
Formula: C19H20 Br4 O4
Molecular Weight: 631.981
Synonyms: Ethanol,2,2'-[isopropylidenebis[(2,6-dibromo-p-phenylene)oxy]]di- (6CI,7CI,8CI); 2,2-Bis[3,5-dibromo-4-(2-hydroxyethoxy)phenyl]propane;2,2-Bis[3,5-dibromo-4-(b-hydroxyethoxy)phenyl]propane;2,2-Bis[4-(2-hydroxyethoxy)-3,5-dibromophenyl]propane;2,2'-Isopropylidenebis[(2,6-dibromo-p-phenyleneoxy)diethanol];4,4'-Isopropylidenebis[2-(2,6-dibromophenoxy)ethanol]; AFR 1011; BA 50; BA 50P;FG 3600; Fire Guard 3600; TBA-EO 20; Tetrabromobisphenol A bis(2-hydroxyethyl)ether
EINECS: 224-005-4
Density: 1.839g/cm3
Melting Point: 108-114 ºC
Boiling Point: 582.1°Cat760mmHg
Flash Point: 305.8°C
Appearance: Beige flakes.
Hazard Symbols:
Risk Codes: R36/37/38   
Safety: S26;S37/39
PSA: 58.92000
LogP: 5.80470
Synthetic route
4162-45-2

2,2′-((propane-2,2-diylbis(2,6-dibromo-4,1-phenylene))bis(oxy)) bis(ethan-1-ol)

1087-21-4

diallyl isophthalate

A

poly(2,2-bis[4-(2-hydroxyethoxy)-3,5-dibromophenyl]propane-co-diallyl isophthalate)

poly(2,2-bis[4-(2-hydroxyethoxy)-3,5-dibromophenyl]propane-co-diallyl isophthalate)

B

107-18-6

allyl alcohol

Conditions
ConditionsYield
With dibutyltin oxide at 180℃; under 0.975098 - 9.976 Torr; for 1h;
4162-45-2

2,2′-((propane-2,2-diylbis(2,6-dibromo-4,1-phenylene))bis(oxy)) bis(ethan-1-ol)

1026-92-2

diallyl terephthalate

A

poly(2,2-bis[4-(2-hydroxyethoxy)-3,5-dibromophenyl]propane-co-diallyl terephthalate)

poly(2,2-bis[4-(2-hydroxyethoxy)-3,5-dibromophenyl]propane-co-diallyl terephthalate)

B

107-18-6

allyl alcohol

Conditions
ConditionsYield
With dibutyltin oxide at 180℃; under 0.975098 - 9.976 Torr; for 1h;
4162-45-2

2,2′-((propane-2,2-diylbis(2,6-dibromo-4,1-phenylene))bis(oxy)) bis(ethan-1-ol)

30674-80-7

2-Isocyanatoethyl methacrylate

((((((propane-2,2-diylbis(2,6-dibromo-4,1-phenylene))bis(oxy))bis(ethane-2,1-diyl))bis(oxy))bis(carbonyl))bis(azanediyl))bis(ethane-2,1-diyl) bis(2-methylacrylate)

Conditions
ConditionsYield
With stannous octoate In ethyl acetate at 60℃; for 16h;
With stannous octoate In ethyl acetate at 60℃; for 16h;
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Chemistry

Molecule structure of 4,4'-Isopropylidenebis[2-(2,6-dibromophenoxy)ethanol] (CAS NO.4162-45-2):

IUPAC Name: 2-[2,6-Dibromo-4-[2-[3,5-dibromo-4-(2-hydroxyethoxy)phenyl]propan-2-yl]phenoxy]ethanol
Molecular Weight: 631.9757 [g/mol]
Molecular Formula: C19H20Br4O4 
Index of Refraction: 1.621
Molar Refractivity: 120.85 cm3
Molar Volume: 343.4 cm3
Polarizability: 47.91×10-24 cm3
Surface Tension: 51 dyne/cm
Density: 1.839 g/cm3 
Melting Point: 107 °C(lit.)
Flash Point: 305.8 °C
Enthalpy of Vaporization: 91.54 kJ/mol
Boiling Point: 582.1 °C at 760 mmHg
Vapour Pressure: 2.17E-14 mmHg at 25 °C
XLogP3-AA: 6.1
H-Bond Donor: 2
H-Bond Acceptor: 4
Rotatable Bond Count: 8
Exact Mass: 631.805416
MonoIsotopic Mass: 627.80951
Topological Polar Surface Area: 58.9
Heavy Atom Count: 27
Complexity: 391
Canonical SMILES: CC(C)(C1=CC(=C(C(=C1)Br)OCCO)Br)C2=CC(=C(C(=C2)Br)OCCO)Br
InChI: InChI=1S/C19H20Br4O4/c1-19(2,11-7-13(20)17(14(21)8-11)26-5-3-24)12-9-15(22)18(16(23)10-12)27-6-4-25/h7-10,24-25H,3-6H2,1-2H3
InChIKey: RVHUMFJSCJBNGS-UHFFFAOYSA-N
EINECS: 224-005-4
Product Categories of 4,4'-Isopropylidenebis[2-(2,6-dibromophenoxy)ethanol] (CAS NO.4162-45-2): Organics;Bisphenol A type Compounds (for High-Performance Polymer Research); Functional Materials; Reagent for High-Performance Polymer Research ;Alcohols; Monomers;Polymer Science

Safety Profile

Hazard Codes: IrritantXi
Risk Statements: 36/37/38 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-37/39 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S37/39:Wear suitable gloves and eye/face protection.
RIDADR: 3152
WGK Germany: 3
HazardClass: 9
PackingGroup: II

Specification

 4,4'-Isopropylidenebis[2-(2,6-dibromophenoxy)ethanol] (CAS NO.4162-45-2) is also named as 2,2-Bis(3,5-dibromo-4-(2-hydroxyethoxy)phenyl)propane ; Ethoxylated tetrabromobisphenol A ; Tetrabromobisphenol A bis(2-hydroxyethyl) ether ; Ethanol, 2,2'-((1-methylethylidene)bis((2,6-dibromo-4,1-phenylene)oxy))bis- ; Tetrabromobisphenol A bis(ethoxylate) .