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4-Amino-5-Chloro-1-Pentofuranosyl-2(1H)-Pyrimidinone
[CAS# 17676-65-2]

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Identification
Name 4-Amino-5-Chloro-1-Pentofuranosyl-2(1H)-Pyrimidinone
Synonyms 5-Chloro-Ara-C; 5-Chlorocytidine; 5-Chlorocytosine arabinoside
Molecular Structure CAS#: 17676-65-2, 4-Amino-5-Chloro-1-Pentofuranosyl-2(1H)-Pyrimidinone
Molecular Formula C9H12ClN3O5
Molecular Weight 277.66
CAS Registry Number 17676-65-2
SMILES C1=C(C(=NC(=O)N1C2C(C(C(O2)CO)O)O)N)Cl
InChI 1S/C9H12ClN3O5/c10-3-1-13(9(17)12-7(3)11)8-6(16)5(15)4(2-14)18-8/h1,4-6,8,14-16H,2H2,(H2,11,12,17)
InChIKey LOFVQBRIYOQFDZ-UHFFFAOYSA-N
Properties
Density 2.0±0.1g/cm3 (Cal.)
Boiling point 543.2±60.0°C at 760 mmHg (Cal.)
Flash point 282.3±32.9°C (Cal.)
Refractive index 1.77 (Cal.)
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