1-(4-Chloro-3-fluorophenyl)methanamine

Basic Information

View in Editor

CAS Number

72235-58-6

Molecular Formula

C7H7ClFN

Molecular Weight

159.59 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

SMILES

View in Editor

C1=CC(=C(C=C1CN)F)Cl

InChI

InChI=1S/C7H7ClFN/c8-6-2-1-5(4-10)3-7(6)9/h1-3H,4,10H2

InChIKey

HSNPBYKCCNMQNA-UHFFFAOYSA-N

LogP

1.9378

Topological Polar Surface Area

26.02 Å²

Hydrogen Bond Donor/Acceptor

2 / 1

Complexity

110

Safety Information

View Safety Information

Hazard Statement

H227 Combustible liquid
Flammable liquids

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

Hazard Class

Class 8 Class 8

Sensitiveness

Air Sensitive

Synonyms & References

English

AM804283
Benzenemethanamine, 4-chloro-3-fluoro-
4-chloro-3-fluorobenzyl amine
EN300-1259179
HSNPBYKCCNMQNA-UHFFFAOYSA-N
AKOS009158878
DS-18178
Benzenemethanamine,4-chloro-3-fluoro-
4-Chloro-3-fluorobenzylamine
C3344
(4-chloro-3-fluorophenyl)methanamine
SY103917
4-chloro-3-fluorobenzylamine, AldrichCPR
(4-chloro-3-fluoro-phenyl)methanamine
A837460
FT-0692448
MFCD04116008
CK1115
72235-58-6
CS-0062988
DTXSID30373936
SB76033
SCHEMBL295912
(4-Chloro-3-fluorophenyl)methanamine
4-chloro-3-fluoroBenzenemethanamine
(4-chloro-3-fluorophenyl)methylamine
3-fluoro-4-chlorobenzyl amine
4-Chloro-3-Fluorobenzyl Amine
RARECHEM AL BW 1597
SBB028335
VZ35399

MDL Number

MFCD04116008

Customs Code

2921499090

FAQ

What are the physical and chemical properties of 1-(4-Chloro-3-fluorophenyl)methanamine (CAS: 72235-58-6)?

1-(4-Chloro-3-fluorophenyl)methanamine is a white crystalline solid with a molecular weight of approximately 225.58 g/mol. It has a low solubility in water but is more soluble in organic solvents such as ethanol and acetone. The compound shows moderate reactivity and can undergo nucleophilic substitution reactions. It is stable under normal storage conditions but should be protected from moisture and light.

How is 1-(4-Chloro-3-fluorophenyl)methanamine (CAS: 72235-58-6) typically synthesized?

1-(4-Chloro-3-fluorophenyl)methanamine is typically synthesized via a multi-step process involving the protection of an amine, formation of an intermediate, and subsequent deprotection. Common synthetic routes include the use of protecting groups such as tert-butyldimethylsilyl (TBS) group, followed by hydrolysis to obtain the target amine. The overall yield is around 70-80%, with good selectivity and purity achievable under proper conditions.

What industries use 1-(4-Chloro-3-fluorophenyl)methanamine (CAS: 72235-58-6)?

1-(4-Chloro-3-fluorophenyl)methanamine is primarily used in pharmaceuticals, where it serves as an intermediate for the synthesis of various drugs. It is also utilized in the polymer industry for the development of advanced materials, and in the sensor industry for the production of gas sensors. Additionally, it finds applications in the semiconductor industry as a dopant precursor.

What precautions should be taken when handling 1-(4-Chloro-3-fluorophenyl)methanamine (CAS: 72235-58-6)?

When handling 1-(4-Chloro-3-fluorophenyl)methanamine, it is crucial to use appropriate personal protective equipment (PPE), including gloves and safety goggles. The compound should be handled in a well-ventilated area or a fume hood to minimize exposure to vapor. In case of a spill, it should be immediately cleaned up using appropriate absorbent materials, and the area should be flushed with water. For detailed safety information, refer to the Material Safety Data Sheet (MSDS/SDS).