2-Heptyl Chloroformate

CAS: 290819-03-3

Ref. TR-H282990

Product Information

• Name: 2-Heptyl Chloroformate
• Synonyms: Carbonochloridic Acid 1-Methylhexyl Ester, Heptan-2-yl Carbonochloridate

Description

Stability Reactive to Moisture
Applications 2-Heptyl Chloroformate is a potential impurity in the synthesis of Dabigatran Etexilate Mesylate (D100150); a nonpeptide and direct thrombin inhibitor. Antithrombotic.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Zheng, Y., et al.: Org. Process Res. Dev., 18, 744 (2014); Hauel, N., et al.: J. Med. Chem., 45, 1757 (2002); Mungall, D., et al.: Curr. Opin. Invest. Drugs, 3, 095 (2002); Stangier, J., et al.: J. Clin. Pharmacol., 45, 555 (2005)

• Brand: TRC

Chemical properties

• Molecular weight: 178.66
• Formula: C₈H₁₅ClO₂
• Color/Form: Neat
• InChI: InChI=1S/C8H15ClO2/c1-3-4-5-6-7(2)11-8(9)10/h7H,3-6H2,1-2H3
• InChI key: InChIKey=NAPYPXWLUOEKEO-UHFFFAOYSA-N
• SMILES: CCCCCC(C)OC(=O)Cl