4-[(2-Amino-6-methylpyrimidin-4-yl)amino]benzonitrile structure

4-[(2-Amino-6-methylpyrimidin-4-yl)amino]benzonitrile

4-[(2-amino-6-methylpyrimidin-4-yl)amino]benzonitrile

Also Known As: 4-[(2-amino-6-methylpyrimidin-4-yl)amino]benzonitrile|4-((2-Amino-6-methylpyrimidin-4-yl)amino)benzonitrile|4-(2-amino-6-methyl-pyrimidin-4-ylamino)-benzonitrile|Benzonitrile,4-[(2-amino-6-methyl-4-pyrimidinyl)amino]-|4-[(2-AMINO-6-METHYL-PYRIMIDIN-4-YL)AMINO]BENZONITRILE|N/A

CAS: 6965-38-4
Molecular Formula C12H11N5
Molecular Weight 225.10144 g/mol
LogP 1.8
Topological Polar Surface Area 87.6 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 2
Exact Mass 225.10144
Monoisotopic Mass 225.10144
Heavy Atoms 17
Complexity 289.0

Chemical Identifiers

CAS Number 6965-38-4
SMILES CC1=CC(=NC(=N1)N)NC2=CC=C(C=C2)C#N
InChIKey LDKAFKDCQRUJLA-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Heterocyclic Building Blocks (3 patents) Pharmaceutical Intermediates (1 patents)

Product Overview

4-[(2-Amino-6-methylpyrimidin-4-yl)amino]benzonitrile (CAS 6965-38-4), with molecular formula C12H11N5 and molecular weight 225.10144 g/mol. IUPAC: 4-[(2-amino-6-methylpyrimidin-4-yl)amino]benzonitrile.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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4-[(2-Amino-6-methylpyrimidin-4-yl)amino]benzonitrile is a custom synthesis product. We offer services from milligram to kilogram scale.

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