1-(3-Chlorophenyl)-N-methylmethanamine

Basic Information

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CAS Number

39191-07-6

Molecular Formula

C8H10ClN

Molecular Weight

155.63 g/mol

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

97 °C/0.6 mmHg

Refractive Index

n20/D 1.5395(lit.)

SMILES

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CNCC1=CC(=CC=C1)Cl

InChI

InChI=1S/C8H10ClN/c1-10-6-7-3-2-4-8(9)5-7/h2-5,10H,6H2,1H3

InChIKey

ZPNLAQVYPIAHTO-UHFFFAOYSA-N

LogP

2.0594

Topological Polar Surface Area

12.03 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

95.3

Safety Information

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Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H318 Causes serious eye damage
Serious eye damage/eye irritation

Hazard Class

Class 3 Class 3

Sensitiveness

Air Sensitive

Synonyms & References

English

EINECS 254-343-8
CHEMBL1178161
N-Methyl-m-chlorobenzylamine
Z56963343
AKOS000264595
n-methyl-3-chlorobenzylamine
MFCD00045194
F16150
DTXSID4068163
1-(3-chlorophenyl)-N-methyl-methanamine
N-(3-Chlorobenzyl)-N-methylamine
(3-chlorophenyl)-N-methylmethanamine
Benzenemethanamine, 3-chloro-N-methyl-
3-Chloro-N-methylbenzenemethanamine
DS-16761
SCHEMBL297864
1-(3-chlorophenyl)-N-methylmethanamine
UNII-JE3Q5ZMA9Z
ethyl?6-(tert-butoxycarbonylamino)-4-chloropicolinate
SB76076
[(3-chlorophenyl)methyl](methyl)amine
NS00030536
((3-CHLOROPHENYL)METHYL)(METHYL)AMINE
JFJ
3-Chloro-N-methylbenzylamine, 97%
3-Chloro-N-methylbenzylamine
ZPNLAQVYPIAHTO-UHFFFAOYSA-N
CS-0030402
NCGC00374057-01
SY104087
JE3Q5ZMA9Z

MDL Number

MFCD00045194

Customs Code

2921499090

FAQ

What are the physical and chemical properties of 1-(3-Chlorophenyl)-N-methylmethanamine (CAS: 39191-07-6)?

1-(3-Chlorophenyl)-N-methylmethanamine is a crystalline solid with a molecular weight of 193.61 g/mol. It has a low solubility in water but is more soluble in organic solvents like ethanol and acetone. Chemically, it is moderately reactive, particularly towards nucleophilic substitution reactions. This compound is used in organic synthesis and pharmaceuticals.

How is 1-(3-Chlorophenyl)-N-methylmethanamine (CAS: 39191-07-6) typically synthesized?

1-(3-Chlorophenyl)-N-methylmethanamine is usually synthesized via the reaction of 3-chlorophenyl isocyanate with methylamine. The reaction is typically carried out in the presence of a base like triethylamine to improve yield and selectivity. Common solvents include dichloromethane and methylene chloride. The yield is around 75-85%.

What industries use 1-(3-Chlorophenyl)-N-methylmethanamine (CAS: 39191-07-6)?

1-(3-Chlorophenyl)-N-methylmethanamine is primarily used in the pharmaceutical industry for the synthesis of various drugs. It is also utilized in the production of polymers and in chemical sensors due to its functional groups and reactivity. Its use in semiconductors is less common but can be found in specific applications.

What precautions should be taken when handling 1-(3-Chlorophenyl)-N-methylmethanamine (CAS: 39191-07-6)?

When handling 1-(3-Chlorophenyl)-N-methylmethanamine, use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work in a well-ventilated area or a fume hood. Spills should be cleaned up using absorbents and disposed of according to local regulations. Always consult the Safety Data Sheet (SDS) for detailed handling and disposal information.