2-Amino-3-methylbenzonitrile

Name: 2-Amino-3-methylbenzonitrile
Brand: ChemScene
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CAS No. 69797-49-5
Cat. No. CS-0153707
Purity≥98%
MDL No.MFCD09880087

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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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Description

2-Amino-3-methylbenzonitrile features a strategically positioned amino group and nitrile functionality on a methyl-substituted benzene ring, enabling its use in constructing bioactive heterocycles. This electron-rich scaffold facilitates coupling reactions under mild conditions, offering efficient access to pharmaceutical intermediates.

Application

2-Amino-3-methylbenzonitrile serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling efficient access to substituted benzimidazoles, quinoline derivatives, and other heterocyclic scaffolds. Its amino and nitrile groups exhibit complementary reactivity, allowing sequential functionalization under mild conditions. The compound demonstrates excellent bench stability and facilitates straightforward purification, making it well-suited for scalable, multi-step synthesis workflows.

General Information

CAS No. 69797-49-5
Cat. No. CS-0153707
Purity ≥98%
MDL No. MFCD09880087
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₈N₂
Molecular Weight 132.16
Synonym(s) 2-Cyano-6-methylaniline
SMILES CC1=C(C(=CC=C1)C#N)N

Computational Chemistry Data

TPSA 49.81
LogP 1.4489
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 0

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS06
Signal Word : Danger	UN#: 2811
Class : 6.1	Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P264-P270-P330-P405-P501

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Other Classifications

Building Blocks Functional Group Cyanide/Nitrile

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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2-Amino-3-methylbenzonitrile

CAS No. 69797-49-5

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