5-chloro-6-methylpyridin-2-amine

• ChemBase ID: 300112
• Molecular Formular: C6H7ClN2
• Molecular Mass: 142.58618
• Monoisotopic Mass: 142.02977591
• SMILES: Cc1c(ccc(n1)N)Cl
• Canonical SMILES: Nc1ccc(c(n1)C)Cl
• InChI: InChI=1S/C6H7ClN2/c1-4-5(7)2-3-6(8)9-4/h2-3H,1H3,(H2,8,9)
• InChIKey: SHIKRPPKGCWKJO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5-chloro-6-methylpyridin-2-amine
• IUPAC Traditional name: 5-chloro-6-methylpyridin-2-amine
• Synonyms: 5-chloro-6-methyl-2-pyridinamine; 5-Chloro-6-methyl-2-pyridinamine; 2-Amino-5-chloro-6-methylpyridine

Database IDs

• CAS Number: 36936-23-9
• MDL Number: MFCD09453335

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 0.8253371
• LogD (pH = 7.4): 1.2471554
• Log P: 1.2565198
• Molar Refractivity: 38.3113 cm^3
• Polarizability: 14.2164345 Å^3
• Polar Surface Area: 38.91 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• European Hazard Symbols: X
• Risk Statements: 22-36/37/38
• Safety Statements: 26-36/37-60
• TSCA Listed: 否
• GHS Pictograms: GHS06
• GHS Hazard statements: H301-H315-H319-H335
• GHS Precautionary statements: P261-P301+P310-P305+P351+P338-P302+P352-P405-P501

Product Information

• Purity: 97%