Chlorozotocin
[CAS# 54749-90-5]

Identification

• Name: Chlorozotocin
• Synonyms: 1-(2-Chloroethyl)-1-Nitroso-3-[2,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-3-Yl]Urea; 1-(2-Chloroethyl)-1-Nitroso-3-[2,4,5-Trihydroxy-6-(Hydroxymethyl)-3-Tetrahydropyranyl]Urea; 1-(2-Chloroethyl)-1-Nitroso-3-(2,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-3-Yl)Urea
• Molecular Formula: C₉H₁₆ClN₃O₇
• Molecular Weight: 313.69
• CAS Registry Number: 54749-90-5
• SMILES: C(C1C(C(C(C(O1)O)NC(N(CCCl)N=O)=O)O)O)O
• InChI: 1S/C9H16ClN3O7/c10-1-2-13(12-19)9(18)11-5-7(16)6(15)4(3-14)20-8(5)17/h4-8,14-17H,1-3H2,(H,11,18)
• InChIKey: MYBLAOJMRYYKMS-UHFFFAOYSA-N

Properties

• Density: 1.858g/cm³ (Cal.)