2,4-Dimethylbenzylamine

Name: 2,4-Dimethylbenzylamine
Brand: ChemScene
Availability: InStock
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CAS No. 94-98-4
Cat. No. CS-W001690
Purity≥97%
MDL No.MFCD00025575

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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Structure of 94-98-4

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Description

2,4-Dimethylbenzylamine features a benzylamine core with methyl groups at the 2- and 4-positions, enhancing steric shielding and electronic stability. This configuration imparts improved solubility in organic media and resistance to oxidation during handling. The compound serves as a robust building block for synthesizing bioactive molecules, particularly in medicinal chemistry and agrochemical development, where its tailored reactivity streamlines coupling reactions under mild conditions.

Application

2,4-Dimethylbenzylamine serves as a versatile building block in medicinal chemistry, offering enhanced lipophilicity and metabolic stability compared to unsubstituted analogs. Its ortho-methyl groups provide steric shielding, improving bench stability and reducing unwanted side reactions. The primary amine enables straightforward derivatization via amide coupling, reductive amination, or alkylation, facilitating access to diverse target molecules. Functions effectively in both solution-phase and solid-phase synthesis, particularly valuable for constructing kinase inhibitors and GPCR-targeted scaffolds.

General Information

CAS No. 94-98-4
Cat. No. CS-W001690
Purity ≥97%
MDL No. MFCD00025575
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₁₃N
Molecular Weight 135.21
Synonym(s) 1-(2,4-dimethylphenyl)methanamine
SMILES CC1=CC(C)=C(CN)C=C1

Computational Chemistry Data

TPSA 26.02
LogP 1.76214
H_Acceptors 1
H_Donors 1
Rotatable_Bonds 1

Safety Information

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GHS Pictogram :	GHS No : GHS05,GHS07
Signal Word : Danger	UN#: 2735
Class : 8	Packing Group : Ⅲ
Hazard Statements : H302-H314
Precautionary Statements : P260-P264-P270-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P330-P363-P405-P501

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Other Classifications

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

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2,4-Dimethylbenzylamine

CAS No. 94-98-4

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