3544-25-0 | 4-Aminophenylacetonitrile

Packsize	Purity	Availability	Price	Discounted Price
10g	98%	in stock	$9.00	$7.00
25g	98%	in stock	$17.00	$12.00

Description

• Catalog Number: AB66662
• Chemical Name: 4-Aminophenylacetonitrile
• CAS Number: 3544-25-0
• Molecular Formula: C8H8N2
• Molecular Weight: 132.1625
• MDL Number: MFCD00007912
• SMILES: N#CCc1ccc(cc1)N

Computed Properties

• Complexity: 137
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 10
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 1.2

Literature

• 4-Chloro-anilinium 4-methyl-benzene-sulfonate.

  Acta crystallographica. Section E, Structure reports online 20111201

• 3-Fluoro-anilinium 4-methyl-benzene-sulfonate.

  Acta crystallographica. Section E, Structure reports online 20111101

• 3-Chloro-anilinium 4-methyl-benzene-sulfonate.

  Acta crystallographica. Section E, Structure reports online 20111101

• 4-(cyanomethyl)anilinium perchlorate: a new displacive-type molecular ferroelectric.

  Physical review letters 20110930

• Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

  Bioorganic & medicinal chemistry letters 20101101

• 4-(Cyano-meth-yl)anilinium 4-methyl-benzene-sulfonate monohydrate.

  Acta crystallographica. Section E, Structure reports online 20100701

• 4-(Cyano-meth-yl)anilinium chloride.

  Acta crystallographica. Section E, Structure reports online 20100601

• Prediction of genotoxicity of chemical compounds by statistical learning methods.

  Chemical research in toxicology 20050601