Gemcitabine

Description: Gemcitabine/Gemzar is used to treat a number of types of cancer including breast cancer, ovarian cancer, non-small cell lung cancer, pancreatic cancer, and bladder cancer.

• Catalog: OFC95058814
• CAS: 95058-81-4
• Category: Fluorinated APIs
• Synonyms: Gemzar
• Purity: 97%

• IUPAC Name: 4-amino-1-[(2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
• InChI: InChI=1S/C9H11F2N3O4/c10-9(11)6(16)4(3-15)18-7(9)14-2-1-5(12)13-8(14)17/h1-2,4,6-7,15-16H,3H2,(H2,12,13,17)/t4-,6-,7-/m1/s1
• InChI Key: SDUQYLNIPVEERB-QPPQHZFASA-N
• Isomeric SMILES: C1=CN(C(=O)N=C1N)[C@H]2C([C@@H]([C@H](O2)CO)O)(F)F
• EC Number: 619-100-6

• Molecular Formula: C9H11F2N3O4
• Molecular Weight: 263.2
• Appearance: Off-white powder

• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 263.07176216 g/mol
• Monoisotopic Mass: 263.07176216 g/mol
• Topological Polar Surface Area: 108Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 426