Ethyl 2-((3,4-dichlorobenzyl)thio)-4-(2-methyl-1-aziridinyl)-5-pyrimidinecarboxylate

Base Information

• Chemical Name: Ethyl 2-((3,4-dichlorobenzyl)thio)-4-(2-methyl-1-aziridinyl)-5-pyrimidinecarboxylate
• CAS No.: 4906-09-6
• Molecular Formula: C17H17Cl2N3O2S
• Molecular Weight: 398.3068
• NSC Number: 59246
• DSSTox Substance ID: DTXSID30289109

Synonyms:NSC59246;4906-09-6;Ethyl 2-((3,4-dichlorobenzyl)thio)-4-(2-methyl-1-aziridinyl)-5-pyrimidinecarboxylate;NCIOpen2_007739;DTXSID30289109;NSC-59246;ethyl 2-[(3,4-dichlorophenyl)methylsulfanyl]-4-(2-methylaziridin-1-yl)pyrimidine-5-carboxylate

Chemical Property of Ethyl 2-((3,4-dichlorobenzyl)thio)-4-(2-methyl-1-aziridinyl)-5-pyrimidinecarboxylate

Chemical Property:

• Vapor Pressure: 4.04E-12mmHg at 25°C
• Boiling Point: 549.4°Cat760mmHg
• Flash Point: 286.1°C
• Density: 1.43g/cm³
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 397.0418534
• Heavy Atom Count: 25
• Complexity: 473

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CN=C(N=C1N2CC2C)SCC3=CC(=C(C=C3)Cl)Cl

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