1-(3,5-Dimethylphenyl)methanamine

Basic Information

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CAS Number

78710-55-1

Molecular Formula

C9H13N

Molecular Weight

135.21 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Physical Properties

Boiling Point

102 °C

Density

0.94

SMILES

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CC1=CC(=CC(=C1)CN)C

InChI

InChI=1S/C9H13N/c1-7-3-8(2)5-9(4-7)6-10/h3-5H,6,10H2,1-2H3

InChIKey

DZBHNPJZCQWUCG-UHFFFAOYSA-N

LogP

1.76214

Topological Polar Surface Area

26.02 Å²

Hydrogen Bond Donor/Acceptor

2 / 1

Complexity

90.9

Safety Information

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Hazard Statement

Hazard Class

Class AIR SENSITIVE Class AIR SENSITIVE

Class CORROSIVE Class CORROSIVE

Synonyms & References

English

CS-0280412
AS-44226
(3,5-dimethylphenyl)methanamine
FT-0641689
(3,5-dimethyl)benzylamine
2-(45-DIHYDRO-1H-IMIDAZOL-2-YL)PHENOL
3,5-dimethylbenzylamin
EN300-298360
DTXSID00999965
NS00062378
AB01824
DZBHNPJZCQWUCG-UHFFFAOYSA-N
SCHEMBL43251
3,5-Dimethylbenzylamine
78710-55-1
EINECS 278-974-3
A839476
3,5-Dimethylbenzylamine, AldrichCPR
AKOS000163738
MFCD00040753
1-(3,5-dimethylphenyl)methanamine
(3,5-Dimethylphenyl)methanamine

MDL Number

MFCD00040753

Customs Code

2921499090

FAQ

What are the physical and chemical properties of 1-(3,5-Dimethylphenyl)methanamine (CAS: 78710-55-1)?

1-(3,5-Dimethylphenyl)methanamine (CAS: 78710-55-1) is a colorless to light yellow liquid with a molecular weight of approximately 166.23 g/mol. It has a high boiling point (152°C) and low solubility in water (0.3 g/100 mL at 20°C). It is reactive towards bases and nucleophiles, making it suitable for various synthetic applications.

How is 1-(3,5-Dimethylphenyl)methanamine (CAS: 78710-55-1) typically synthesized?

1-(3,5-Dimethylphenyl)methanamine is typically synthesized via alkylation of aniline with 3,5-dimethylbenzaldehyde. This process usually involves the use of a phase-transfer catalyst, such as tetrabutylammonium bromide, to improve the reaction yield and selectivity. The synthesis is exothermic and should be carefully monitored to prevent overheating.

What industries use 1-(3,5-Dimethylphenyl)methanamine (CAS: 78710-55-1)?

1-(3,5-Dimethylphenyl)methanamine is used in various industries, including pharmaceuticals for the synthesis of certain drugs, polymers for the production of functional materials, and as a precursor in the manufacturing of sensors and semiconductors. Its unique structure makes it valuable in several advanced chemical applications.

What precautions should be taken when handling 1-(3,5-Dimethylphenyl)methanamine (CAS: 78710-55-1)?

When handling 1-(3,5-Dimethylphenyl)methanamine (CAS: 78710-55-1), appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat should be worn. Work should be conducted in a fume hood to minimize inhalation risks. Spills should be cleaned up immediately using appropriate absorbent materials, and the area should be well-ventilated. Always refer to the Safety Data Sheet (SDS) for detailed handling and emergency procedures.