2-Acetylbenzonitrile

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

CAS No. 91054-33-0
Cat. No. CS-W005120
Purity≥98%
MDL No.MFCD00272571

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.

Structure of 91054-33-0

Size

Price

Quantity

* Please select Quantity before adding items.

General Information

CAS No. 91054-33-0
Cat. No. CS-W005120
Purity ≥98%
MDL No. MFCD00272571
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₇NO
Molecular Weight 145.16
Synonym(s) 2-Acetylbenzenecarbonitrile
SMILES C1=CC=CC(=C1C#N)C(C)=O

Description

2-Acetylbenzonitrile features a fused aromatic system bearing both acetyl and nitrile functionalities, enabling direct integration into heterocyclic synthesis. The ortho-positioned electron-withdrawing nitrile group enhances reactivity at the carbonyl center, facilitating nucleophilic addition under mild conditions. This compound serves as a key intermediate in the development of pharmaceuticals and functional materials.

Application

2-Acetylbenzonitrile serves as a versatile building block in synthetic organic chemistry, enabling efficient access to substituted benzimidazoles and heterocyclic scaffolds via condensation reactions. Its dual functionality—readily participating in nucleophilic additions and electrophilic substitutions—supports diverse transformations under mild conditions. The molecule exhibits good bench stability and facilitates straightforward purification, making it well-suited for iterative synthesis workflows in medicinal chemistry and process development.

Synthesis

Route1
- 2042-37-7
- 75-36-5
- ~25%
- In-stock
  
  91054-33-0
References
- Fillon, Hyacinthe; Gosmini, Corinne; Perichon, Jacques Tetrahedron, 2003 , vol. 59, # 41 p. 8199 - 8202
Route2
- 6213-94-1
- In-stock
  
  4387-36-4
- ~56%
- In-stock
  
  91054-33-0
References
- Qian, Wangke; Zhang, Lei; Sun, Haifeng; Jiang, Hualiang; Liu, Hong Advanced Synthesis and Catalysis, 2012 , vol. 354, # 17 p. 3231 - 3236
Route3
- 304669-50-9
- ~%
- In-stock
  
  91054-33-0
References
- Journal of Organic Chemistry, , vol. 57, # 5 p. 1481 - 1486

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 40.86
LogP 1.76088
H_Acceptors 2
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Ketone

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

2-Acetylbenzonitrile sigma2-Acetylbenzonitrile manufacturer2-Acetylbenzonitrile price2-Acetylbenzonitrile structure2-Acetylbenzonitrile SDSbuy 2-Acetylbenzonitrile2-Acetylbenzonitrile supplier2-Acetylbenzonitrile uses2-Acetylbenzonitrile molecular weightprice of 2-Acetylbenzonitrile2-Acetylbenzonitrile chemical name formula of 2-Acetylbenzonitrile

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-Acetylbenzonitrile

CAS No. 91054-33-0

Recommended Products

General Information

Description

Application

Synthesis

References

References

References

Safety Information

Quality Control

Computational Chemistry Data

Similar Products

Other Classifications

Recently Viewed Products

Key Words