1772-76-5 | 3-Nitrocinnamic acid

Packsize	Purity	Availability	Price	Discounted Price
5g	97%	in stock	$10.00	$7.00
25g	97%	in stock	$46.00	$32.00
100g	97%	in stock	$182.00	$127.00

Description

• Catalog Number: AE93954
• Chemical Name: 3-Nitrocinnamic acid
• CAS Number: 1772-76-5
• Molecular Formula: C9H7NO4
• Molecular Weight: 193.1562
• MDL Number: MFCD00007277
• SMILES: OC(=O)C=Cc1cccc(c1)[N+](=O)[O-]

Computed Properties

• Complexity: 256
• Covalently-Bonded Unit Count: 1
• Defined Bond Stereocenter Count: 1
• Heavy Atom Count: 14
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 1.5

Literature

• Structure-activity relationships of trans-substituted-propenoic acid derivatives on the nicotinic acid receptor HCA2 (GPR109A).

  Bioorganic & medicinal chemistry letters 20110501

• Synthesis and structure--activity relationships of substituted cinnamic acids and amide analogues: a new class of herbicides.

  Journal of agricultural and food chemistry 20090422

• Esters, amides and substituted derivatives of cinnamic acid: synthesis, antimicrobial activity and QSAR investigations.

  European journal of medicinal chemistry 20041001