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4-(5-Pyrimidinyl)-1,4-diazabicyclo[3.1.1]heptane
[CAS# 675591-29-4]

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Identification
Name 4-(5-Pyrimidinyl)-1,4-diazabicyclo[3.1.1]heptane
Synonyms 4-(pyrimidin-5-yl)-1,4-diazabicyclo[3.1.1]heptane
Molecular Structure CAS#: 675591-29-4, 4-(5-Pyrimidinyl)-1,4-diazabicyclo[3.1.1]heptane
Molecular Formula C9H12N4
Molecular Weight 176.22
CAS Registry Number 675591-29-4
SMILES n1cc(cnc1)N3C2CN(C2)CC3
InChI 1S/C9H12N4/c1-2-13(9-5-12(1)6-9)8-3-10-7-11-4-8/h3-4,7,9H,1-2,5-6H2
InChIKey IPEXQVDYKNICCV-UHFFFAOYSA-N
Properties
Density 1.313g/cm3 (Cal.)
Boiling point 319.806°C at 760 mmHg (Cal.)
Flash point 147.214°C (Cal.)
Refractive index 1.653 (Cal.)
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