CAS 1197237-84-5

[1,1′-Biphenyl]-3-carbonitrile, 2′-amino-, hydrochloride (1:1)

Description:

[1,1′-Biphenyl]-3-carbonitrile, 2′-amino-, hydrochloride (1:1) is a chemical compound characterized by its biphenyl structure, which consists of two phenyl rings connected by a single bond. The presence of a carbonitrile group (-C≡N) at the 3-position and an amino group (-NH2) at the 2′-position of one of the phenyl rings contributes to its reactivity and potential applications in organic synthesis and pharmaceuticals. As a hydrochloride salt, it is typically more soluble in water compared to its free base form, which can enhance its bioavailability in biological systems. The compound may exhibit various properties such as moderate to high melting points, depending on its purity and crystalline form. Its functional groups suggest potential for hydrogen bonding and interactions with biological targets, making it of interest in medicinal chemistry. Safety data should be consulted for handling and storage, as with any chemical substance, to ensure proper laboratory practices are followed.

Formula: C₁₃H₁₀N₂·ClH

InChI: InChI=1S/C13H10N2.ClH/c14-9-10-4-3-5-11(8-10)12-6-1-2-7-13(12)15;/h1-8H,15H2;1H

InChI key: InChIKey=TXROKWXVVFVTDC-UHFFFAOYSA-N

SMILES: NC1=C(C2=CC(C#N)=CC=C2)C=CC=C1.Cl

Synonyms:

• [1,1′-Biphenyl]-3-carbonitrile, 2′-amino-, hydrochloride (1:1)