5326-23-8 | 6-Chloronicotinic acid

Packsize	Purity	Availability	Price	Discounted Price
10g	95%	in stock	$6.00	$5.00
25g	95%	in stock	$8.00	$6.00
100g	98%	in stock	$20.00	$14.00

Description

• Catalog Number: AB69821
• Chemical Name: 6-Chloronicotinic acid
• CAS Number: 5326-23-8
• Molecular Formula: C6H4ClNO2
• Molecular Weight: 157.5545
• MDL Number: MFCD00006241
• SMILES: Clc1ccc(cn1)C(=O)O
• NSC Number: 277

Computed Properties

• Complexity: 140
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 10
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 2.7

Literature

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• Comparison of experimental and density functional study on the molecular structure, infrared and Raman spectra and vibrational assignments of 6-chloronicotinic acid.

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• Efficient synthesis of novel NK1 receptor antagonists: selective 1,4-addition of grignard reagents to 6-chloronicotinic acid derivatives.

  The Journal of organic chemistry 20060303

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  The Analyst 20010801

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