5-(Chloromethyl)pyrimidine

Base Information

• Chemical Name: 5-(Chloromethyl)pyrimidine
• CAS No.: 101346-02-5
• Molecular Formula: C5H5ClN2
• Molecular Weight: 128.561
• Hs Code.: 2933599090
• DSSTox Substance ID: DTXSID70563354
• Wikidata: Q72454994
• Mol file: 101346-02-5.mol

Synonyms:5-(Chloromethyl)pyrimidine;101346-02-5;5-CHLOROMETHYLPYRIMIDINE;5-Chloromethyl-pyrimidine;PYRIMIDINE, 5-(CHLOROMETHYL)-;Pyrimidine, 5-(chloromethyl)- (9CI);5-chlo-romethylpyrimidine;SCHEMBL26505;DTXSID70563354;JTDIIDXRVCNTDU-UHFFFAOYSA-N;AKOS005255407;PB34530;AC-28833;AM20070663;CS-0053749;EN300-226521;P10951;A800377;W-204406

Chemical Property of 5-(Chloromethyl)pyrimidine

Chemical Property:

• Vapor Pressure: 0.18mmHg at 25°C
• Refractive Index: 1.534
• Boiling Point: 219 °C at 760 mmHg
• PKA: 1.63±0.10(Predicted)
• Flash Point: 107 °C
• PSA: 25.78000
• Density: 1.241 g/cm³
• LogP: 1.21540
• XLogP3: 0
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 128.0141259
• Heavy Atom Count: 8
• Complexity: 61.4

Purity/Quality:

99% ^*data from raw suppliers

5-(Chloromethyl)pyrimidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=NC=N1)CCl
• Uses: 5-(Chloromethyl)pyrimidine Hydrochloride can be used as PAD inhibitors to treat various disorders.