2-(Allyloxy)-1,3,5-tribromobenzene

Basic Information

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CAS Number

3278-89-5

Molecular Formula

C9H7Br3O

Molecular Weight

370.87 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

74-76 ºC

SMILES

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C=CCOC1=C(C=C(C=C1Br)Br)Br

InChI

InChI=1S/C9H7Br3O/c1-2-3-13-9-7(11)4-6(10)5-8(9)12/h2,4-5H,1,3H2

InChIKey

RZLLIOPGUFOWOD-UHFFFAOYSA-N

LogP

4.538900000000001

Topological Polar Surface Area

9.23 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

162

Synonyms & References

English

3278-89-5
1,3,5-Tribromo-2-(2-propenyloxy)-benzene
Allyl 2,4,6-tribromophenyl ether
2-(Allyloxy)-1,3,5-tribromobenzene #
RZLLIOPGUFOWOD-UHFFFAOYSA-N
NCGC00256197-01
2-(Allyloxy)-1,3,5-tribromobenzene
Allyl 2,6-tribromophenyl ether
CHEMBL3188631
Q27255479
Ether,4,6-tribromophenyl
SCHEMBL42433
FR-913
2QB5393K07
InChI=1/C9H7Br3O/c1-2-3-13-9-7(11)4-6(10)5-8(9)12/h2,4-5H,1,3H
2,6-Tribromophenylallyl ether
PYROGUARD FR 100
NS00009674
2,4,6-tribromophenyl allyl ether
1,3,5-Tribromo-2-(prop-2-en-1-yloxy)benzene
Great lakes PHE-65
DTXSID3044918
MFCD00017773
E79371
TBP-AE
1,3,5-Tribromo-2-(2-propenyloxy)-benzene; Allyl 2,4,6-Tribromophenyl Ether; 2,4,6-Tribromophenyl Allyl Ether; Allyl 2,4,6-Tribromophenyl Ether; NSC 35767; Pyroguard FR 100
Benzene, 1,3,5-tribromo-2-(2-propenyloxy)-
AKOS015889437
Benzene,3,5-tribromo-2-(2-propenyloxy)-
FT-0634756
2-ALLYLOXY-1,3,5-TRIBROMOBENZENE

MDL Number

MFCD00017773

Customs Code

2909309090

FAQ

What are the physical and chemical properties of 2-(Allyloxy)-1,3,5-tribromobenzene (CAS: 3278-89-5)?

2-(Allyloxy)-1,3,5-tribromobenzene (CAS: 3278-89-5) is a crystalline compound with a molecular weight of approximately 414.01 g/mol. It has low water solubility but is more soluble in organic solvents like chloroform and acetone. Chemically, it is highly reactive due to the presence of bromine atoms and the allyloxy group, making it prone to substitution reactions and photodegradation.

How is 2-(Allyloxy)-1,3,5-tribromobenzene (CAS: 3278-89-5) typically synthesized?

2-(Allyloxy)-1,3,5-tribromobenzene is typically synthesized via a multistep process involving bromination of 2-allyloxybenzene followed by electrophilic aromatic substitution. The synthesis often requires the use of aluminum bromide as a catalyst and involves several purification steps to obtain the desired product with high selectivity and yield.

What industries use 2-(Allyloxy)-1,3,5-tribromobenzene (CAS: 3278-89-5)?

2-(Allyloxy)-1,3,5-tribromobenzene (CAS: 3278-89-5) is primarily used in the pharmaceutical industry for the synthesis of certain drugs. It also finds applications in polymer chemistry for modifying properties of polymers, in sensor technology for developing highly sensitive detection devices, and in semiconductor manufacturing for its unique electronic properties.

What precautions should be taken when handling 2-(Allyloxy)-1,3,5-tribromobenzene (CAS: 3278-89-5)?

When handling 2-(Allyloxy)-1,3,5-tribromobenzene (CAS: 3278-89-5), it is crucial to use proper personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a fume hood to minimize inhalation risks. In case of a spill, evacuate the area immediately and follow emergency protocols. Always refer to the Material Safety Data Sheet (MSDS) for detailed safety information.