5-Bromo-2-methoxybenzonitrile

Basic Information

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CAS Number

144649-99-0

Molecular Formula

C8H6BrNO

Molecular Weight

201.06 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Nitriles

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

91-92 °C

Boiling Point

287.8±20.0 ºC (760 Torr),

Density

1.56±0.1 g/cm3 (20 ºC 760 Torr),

Flash Point

127.9±21.8 ºC,

Refractive Index

1.584

SMILES

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COC1=C(C=C(C=C1)Br)C#N

InChI

InChI=1S/C8H6BrNO/c1-11-8-3-2-7(9)4-6(8)5-10/h2-4H,1H3

InChIKey

LOASAXVECBZCRJ-UHFFFAOYSA-N

LogP

2.766120000000001

Topological Polar Surface Area

9.23 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

174

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H312 Harmful in contact with skin
Acute toxicity, dermal

H332 Harmful if inhaled
Acute toxicity, inhalation

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

AMY28368
4-Bromo-2-cyanoanisole
AKOS000113861
J-007989
Z57756592
Benzonitrile,5-bromo-2-methoxy-
PS-5783
SCHEMBL393816
144649-99-0
MFCD00143429
SY030630
LOASAXVECBZCRJ-UHFFFAOYSA-N
J-516957
5-bromo-2-methoxybenzonitrile
EN300-49579
5-bromo-2-methoxy-benzonitrile
Benzonitrile, 5-bromo-2-methoxy-
DTXSID20403079
BB 0244143
Benzonitrile, 5-?bromo-?2-?methoxy-
PB48608
CS-0042159
5-bromo-2-(methyloxy)benzonitrile
B3123
FT-0679453
5-Bromo-2-methoxybenzonitrile, 96%
5-Bromo-2-methoxybenzonitrile
5-Bromo-o-anisyl cyanide
2-methoxy-5-bromobenzonitrile
5-bromo-2-methoxybenzenecarbonitrile
5-Bromo-2-methoxy-benzonitrile

MDL Number

MFCD00143429

Customs Code

2926909090

FAQ

What is 5-Bromo-2-methoxybenzonitrile (CAS: 144649-99-0)?

5-Bromo-2-methoxybenzonitrile (CAS: 144649-99-0) is a organic compound with the chemical formula C8H9BrNO. It is a colorless to light yellow liquid with a bromine odor. It is used in the synthesis of pharmaceuticals and dyes.

What are the main uses of 5-Bromo-2-methoxybenzonitrile (CAS: 144649-99-0)?

5-Bromo-2-methoxybenzonitrile (CAS: 144649-99-0) is primarily used in the pharmaceutical industry for the synthesis of drugs and in the chemical industry for the production of dyes.

Is 5-Bromo-2-methoxybenzonitrile (CAS: 144649-99-0) safe?

5-Bromo-2-methoxybenzonitrile (CAS: 144649-99-0) is generally safe when handled with proper precautions. However, it is toxic and may cause skin and eye irritation. It is recommended to wear protective gloves and eye protection when handling the compound.

How should 5-Bromo-2-methoxybenzonitrile (CAS: 144649-99-0) be stored?

5-Bromo-2-methoxybenzonitrile (CAS: 144649-99-0) should be stored in a cool, dry place away from direct sunlight. It should be kept in well-sealed, airtight containers to prevent moisture absorption. The storage area should be well-ventilated to ensure good air circulation.