4-Chloro-2-(Methylsulfanyl)-6-(1-Pyrrolidinyl)-5-Pyrimidinecarbaldehyde
[CAS# 445040-59-5]

Identification

• Name: 4-Chloro-2-(Methylsulfanyl)-6-(1-Pyrrolidinyl)-5-Pyrimidinecarbaldehyde
• Synonyms: 4-chloro-2-(methylthio)-6-(pyrrolidin-1-yl)pyrimidine-5-carbaldehyde; 4-chloro-2-(methylthio)-6-pyrrolidin-1-ylpyrimidine-5-carbaldehyde; 4-Chloro-2-methylsulfanyl-6-pyrrolidin-1-yl-pyrimidine-5-carbaldehyde
• Molecular Formula: C₁₀H₁₂ClN₃OS
• Molecular Weight: 257.74
• CAS Registry Number: 445040-59-5
• SMILES: CSC1=NC(=C(C(=N1)Cl)C=O)N2CCCC2
• InChI: 1S/C10H12ClN3OS/c1-16-10-12-8(11)7(6-15)9(13-10)14-4-2-3-5-14/h6H,2-5H2,1H3
• InChIKey: OTBUQFUXWDJOIY-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 435.5±45.0°C at 760 mmHg (Cal.)
• Flash point: 217.2±28.7°C (Cal.)
• Refractive index: 1.628 (Cal.)

Safety Data

• Safety Description: IRRITANT