2-Amino-5-isopropylbenzonitrile

Name: 2-Amino-5-isopropylbenzonitrile
Brand: ChemScene
Availability: InStock
Rating: 5 (1 reviews)

CAS No. 549488-76-8
Cat. No. CS-0154286
Purity≥98%
MDL No.MFCD11977495

HazMat Fee +

HazMat Fee

An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it. There is a HazMat shipping fee for each item that qualifies as a dangerous good, except in the following scenarios:

The shipment is processed through FedEx Ground under the Limited Quantity option.

Each bottle is packed as an Excepted Quantity, with a maximum of 1g for items in class 6.1 packing group I or II, and up to 25g for all other hazardous materials.

If shipping is charged to your FedEx account, the HazMat fee will be billed directly by the courier. Otherwise, the fee will be included on your invoice. To help you avoid the HazMat fee, we can package a 5g order of a class 6.1 packing group I or II material as five separate 1g units, and a 100g order of any other dangerous good as four 25g units. This packaging adjustment will be made unless you instruct otherwise on your purchase order. Below, you will find the fee schedule from FedEx for handling hazardous materials.

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+

An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it.

There is a HazMat shipping fee for each item that qualifies as a dangerous good. Please contact our quotation team via email to confirm the details.

*For research and further manufacturing use only, not for direct human use.

2-Amino-5-isopropylbenzonitrile|CS-0154286

Structure of 549488-76-8

Size

Price

Quantity

* Please select Quantity before adding items.

General Information

CAS No. 549488-76-8
Cat. No. CS-0154286
Purity ≥98%
MDL No. MFCD11977495
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₁₂N₂
Molecular Weight 160.22
Synonym(s) Benzonitrile, 2-amino-5-(1-methylethyl)- (9CI)
SMILES CC(C)C1=CC(=C(C=C1)N)C#N

Description

2-Amino-5-isopropylbenzonitrile features a strategically positioned nitrile group flanked by an amino substituent and a sterically hindered isopropyl moiety, enabling robust integration into heterocyclic scaffolds. This electron-rich aryl building block offers enhanced solubility and stability under standard bench conditions, streamlining synthesis workflows in medicinal chemistry and materials development.

Application

2-Amino-5-isopropylbenzonitrile serves as a versatile building block in medicinal chemistry, enabling the synthesis of substituted benzimidazoles and other heterocyclic scaffolds. Its ortho-amino and nitrile functionalities offer complementary reactivity for cyclization, amidation, and coupling reactions. The isopropyl group provides steric bulk and metabolic stability, enhancing its utility in drug discovery workflows. The compound exhibits good bench stability and facilitates straightforward purification, making it well-suited for scalable synthesis and process development.

Synthesis

Route1
- In-stock
  
  51605-97-1
- 544-92-3
- ~90%
- In-stock
  
  549488-76-8
References
- ELI LILLY AND COMPANY Patent: WO2004/14895 A1, 2004 ; Location in patent: Page 65-66 ; WO 2004/014895 A1

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

To search for quality control of cas , please enter both the product number and the lot/batch number.

Computational Chemistry Data

TPSA 49.81
LogP 2.26388
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Cyanide/Nitrile

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

2-Amino-5-isopropylbenzonitrile sigma2-Amino-5-isopropylbenzonitrile manufacturer2-Amino-5-isopropylbenzonitrile price2-Amino-5-isopropylbenzonitrile structure2-Amino-5-isopropylbenzonitrile SDSbuy 2-Amino-5-isopropylbenzonitrile2-Amino-5-isopropylbenzonitrile supplier2-Amino-5-isopropylbenzonitrile uses2-Amino-5-isopropylbenzonitrile molecular weightprice of 2-Amino-5-isopropylbenzonitrile2-Amino-5-isopropylbenzonitrile chemical name formula of 2-Amino-5-isopropylbenzonitrile

Salutation:	*Country or Region:
*Applicant Name:	*Organization Name:
*Email Address:	Quantity:
CAS NO. :	Product Name:
Remarks:
Upload Pictures

CAS.No.		Product Name
Applicant Name *		Email Address *
Phone Number *		Organization Name*
Country or Region*		Quantity*
Remarks:

Product Name:
Cat. No.: .		CAS NO. :
Quantity:

2-Amino-5-isopropylbenzonitrile

CAS No. 549488-76-8

Recommended Products