Chemical Properties of 1-(Adamantan-1-yl)pyrazole (CAS 92234-54-3)

1-(Adamantan-1-yl)pyrazole

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InChI
InChI=1S/C13H18N2/c1-2-14-15(3-1)13-7-10-4-11(8-13)6-12(5-10)9-13/h1-3,10-12H,4-9H2
InChI Key
TWAYEKHIDSYYHV-UHFFFAOYSA-N
Formula
C13H18N2
SMILES
c1cnn(C23CC4CC(CC(C4)C2)C3)c1
Molecular Weight1
202.30
CAS
92234-54-3
Other Names
  • 1-(1-adamantyl)pyrazole
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Physical Properties

Property Value Unit Source
PAff 954.50 kJ/mol NIST
BasG 922.40 kJ/mol NIST
log10WS -3.48 Crippen Calculated Property
logPoct/wat 2.808 Crippen Calculated Property
McVol 161.950 ml/mol McGowan Calculated Property

Similar Compounds

3'-acetylsupinine. 3'-acetylindicine. 3'-benzoylindicine. 7-senecioyllycopsamine. 2'-Deoxyuridine, bis(trimethylsilyl) deriv.. 2'-Deoxyuridine, 3',5'-bis(O-TMSi). Isocallimorphine. Callimorphine. Seneciphylline, 12-acetyl. Chanoclavine. 11-Ketoestradiol (enol), TMS. 11-Dehydroestradiol, TMS. Spartioidine, 12-acetyl. Acetylseneciphylline. 17A-11-Dehydroestradiol, TMS.

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Sources

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