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Home >> Chemical Listing >> Page 140 >> 6-Chloro-9-(1-Phenylethyl)-9H-Purine

6-Chloro-9-(1-Phenylethyl)-9H-Purine
[CAS# 112089-30-2]

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Identification
Name 6-Chloro-9-(1-Phenylethyl)-9H-Purine
Synonyms 6-Chloro-9-(1-phenyl-ethyl)-9H-purine; NSC108152
Molecular Structure CAS#: 112089-30-2, 6-Chloro-9-(1-Phenylethyl)-9H-Purine
Molecular Formula C13H11ClN4
Molecular Weight 258.71
CAS Registry Number 112089-30-2
SMILES Clc3ncnc1c3ncn1C(c2ccccc2)C
InChI 1S/C13H11ClN4/c1-9(10-5-3-2-4-6-10)18-8-17-11-12(14)15-7-16-13(11)18/h2-9H,1H3
InChIKey XTFDZVGPYVRMGL-UHFFFAOYSA-N
Properties
Density 1.363g/cm3 (Cal.)
Boiling point 433.999°C at 760 mmHg (Cal.)
Flash point 216.275°C (Cal.)
Refractive index 1.687 (Cal.)
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