1-Bromo-4-methoxy-2-methylbenzene

Basic Information

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CAS Number

27060-75-9

Molecular Formula

C8H9BrO

Molecular Weight

201.06 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

112-114°C

Boiling Point

111-112 °C/15 mmHg

Solubility

water: soluble (Partially miscible)(lit.)

Refractive Index

n20/D 1.561(lit.)

SMILES

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CC1=C(C=CC(=C1)OC)Br

InChI

InChI=1S/C8H9BrO/c1-6-5-7(10-2)3-4-8(6)9/h3-5H,1-2H3

InChIKey

BLZNSXFQRKVFRP-UHFFFAOYSA-N

LogP

2.766120000000001

Topological Polar Surface Area

9.23 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

105

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

2-bromo-5-methoxy toluene
NCGC00258034-01
CAS-27060-75-9
CS-W001186
ANISOLE, 4-BROMO-3-METHYL-
SY009132
A818892
B1782
F0001-0879
J-504449
FT-0611491
4-Bromo-3-methyl-anisole
AM85690
DTXCID609338
2-Bromo-5-methoxytoluene
Benzene, 1-bromo-4-methoxy-2-methyl-
UNII-OKR329132J
J32.078A
NCGC00248650-01
1-bromo-4-methoxy-2-methyl-benzene
NS00120439
4-Bromo-1-methoxy-3-methylbenzene
InChI=1/C8H9BrO/c1-6-5-7(10-2)3-4-8(6)9/h3-5H,1-2H3
AKOS000185073
DTXSID1029338
EN300-84881
AC-20053
Q27285709
4-Bromo-3-methylanisole
1-bromo-4-methoxy-2-methylbenzene
PS-8206

MDL Number

MFCD00060687

Customs Code

2909309090

FAQ

What are the physical and chemical properties of 1-Bromo-4-methoxy-2-methylbenzene (CAS: 27060-75-9)?

1-Bromo-4-methoxy-2-methylbenzene (CAS: 27060-75-9) is a crystalline solid with a molecular weight of approximately 207.03 g/mol. It has a melting point of 57-58°C and is slightly soluble in water. This compound is reactive towards nucleophiles and can undergo substitution reactions. It is insoluble in non-polar solvents and has good solubility in polar solvents like methanol and ethanol.

How is 1-Bromo-4-methoxy-2-methylbenzene (CAS: 27060-75-9) typically synthesized?

1-Bromo-4-methoxy-2-methylbenzene (CAS: 27060-75-9) is typically synthesized via bromination of 4-methoxy-2-methylbenzene using bromine in the presence of a Lewis acid catalyst such as aluminum bromide. The reaction proceeds with good yield and selectivity, making it a straightforward method for preparing this compound.

What industries use 1-Bromo-4-methoxy-2-methylbenzene (CAS: 27060-75-9)?

1-Bromo-4-methoxy-2-methylbenzene (CAS: 27060-75-9) is used in the pharmaceutical industry for the synthesis of certain drug intermediates and in the polymer industry for the production of functional polymers. It is also utilized in the development of sensors and as a precursor in semiconductor manufacturing processes.

What precautions should be taken when handling 1-Bromo-4-methoxy-2-methylbenzene (CAS: 27060-75-9)?

When handling 1-Bromo-4-methoxy-2-methylbenzene (CAS: 27060-75-9), it is essential to wear appropriate personal protective equipment (PPE) such as gloves, protective goggles, and lab coats. Work should be conducted in a well-ventilated area or fume hood. Spills should be cleaned up using appropriate absorbent materials and disposed of according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling and storage information.