1-(4-Bromo-2,6-difluorophenyl)methanamine

Basic Information

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CAS Number

887585-99-1

Molecular Formula

C7H6BrF2N

Molecular Weight

222.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

233.3±35.0 °C at 760 mmHg

Density

1.7±0.1 g/cm3

Flash Point

94.9±25.9 °C

Vapor Pressure

0.1±0.5 mmHg at 25°C

SMILES

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C1=C(C=C(C(=C1F)CN)F)Br

InChI

InChI=1S/C7H6BrF2N/c8-4-1-6(9)5(3-11)7(10)2-4/h1-2H,3,11H2

InChIKey

WAJJIVIBRLOHEU-UHFFFAOYSA-N

LogP

2.186

Topological Polar Surface Area

26.02 Å²

Hydrogen Bond Donor/Acceptor

2 / 1

Complexity

122

Safety Information

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Hazard Statement

Synonyms & References

English

4-BROMO-2,6-DIFLUOROBENZYLAMINE
MFCD04972477
887585-99-1
(4-bromo-2,6-difluorophenyl)methanamine
4-bromo-2,6-difluorobenzyl amine
AB21101
(4-bromo-2,6-difluorophenyl)-methanamine
O10102
WAJJIVIBRLOHEU-UHFFFAOYSA-N
DS-19879
CS-0130072
AKOS015961079
SCHEMBL856734
SY117476
SureCN856734
CTK4D5957
AG-E-26030
AC-12990
KB-207930
4-Bromo-2,6-difluorobenzenemethanamine (ACI)
(4-Bromo-2,6-difluorophenyl)methanamine

MDL Number

MFCD04972477

FAQ

What are the physical and chemical properties of 1-(4-Bromo-2,6-difluorophenyl)methanamine (CAS: 887585-99-1)?

1-(4-Bromo-2,6-difluorophenyl)methanamine is a solid with a crystalline form. Its molecular weight is approximately 281.03 g/mol. It has a low water solubility but is soluble in organic solvents like ethanol and acetone. This compound is reactive and can undergo electrophilic aromatic substitution reactions and nucleophilic aminolysis.

How is 1-(4-Bromo-2,6-difluorophenyl)methanamine (CAS: 887585-99-1) typically synthesized?

1-(4-Bromo-2,6-difluorophenyl)methanamine is typically synthesized via a multi-step process involving the bromination of a 2,6-difluorophenyl group, followed by the substitution of a methylamine. This can be achieved using reagents like N-bromosuccinimide (NBS) and a radical initiator, yielding a high yield of the desired product with good selectivity.

What industries use 1-(4-Bromo-2,6-difluorophenyl)methanamine (CAS: 887585-99-1)?

1-(4-Bromo-2,6-difluorophenyl)methanamine is used in the pharmaceutical industry for the synthesis of certain medicinal compounds. It is also utilized in polymer science for the modification of polymers and in the development of sensors and semiconductors due to its unique chemical properties.

What precautions should be taken when handling 1-(4-Bromo-2,6-difluorophenyl)methanamine (CAS: 887585-99-1)?

Proper personal protective equipment (PPE) such as gloves, goggles, and a lab coat is essential when handling 1-(4-Bromo-2,6-difluorophenyl)methanamine. It should be conducted in a fume hood to minimize inhalation risks. Spills should be cleaned up immediately using appropriate absorbent materials. Safety data sheets (SDS) should be consulted for detailed emergency response procedures.