Chemical Properties of Cyclohexanol, 2-(9h-purin-9-yl)-, trans- (CAS 100057-61-2)

Cyclohexanol, 2-(9h-purin-9-yl)-, trans-

InChI
InChI=1S/C11H14N4O/c16-10-4-2-1-3-9(10)15-7-14-8-5-12-6-13-11(8)15/h5-7,9-10,16H,1-4H2
InChI Key
VJLPIPHTBGYWGJ-UHFFFAOYSA-N
Formula
C11H14N4O
SMILES
OC1CCCCC1n1cnc2cncnc21
Molecular Weight1
218.26
CAS
100057-61-2
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Physical Properties

Property Value Unit Source
ω 0.6558 Relay (1.0) Calculated Property
Δf 296.33 kJ/mol Relay (1.0-beta) Calculated Property
Δfgas 50.64 kJ/mol Relay (1.0) Calculated Property
Δvap 114.37 kJ/mol Relay (1.0) Calculated Property
IE 8.98 eV Relay (1.0) Calculated Property
log10WS -1.60 Relay (1.0) Calculated Property
logPoct/wat 1.302 Crippen Calculated Property
McVol 161.860 ml/mol McGowan Calculated Property
Pc 3696.29 kPa Relay (1.0-beta) Calculated Property
Tboil 648.59 K Relay (1.0) Calculated Property
Tc 960.98 K Relay (1.0) Calculated Property
Tfus 451.63 K Relay (1.0) Calculated Property
Vc 0.610 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Cyclohexanol, 2-(9h-6-chloropurin-9-yl)-, trans. Cyclohexanol, 2-(6-amino-9h-purin-9-yl)-, cis-. Adenine, 9-(2-hydroxycyclohexyl)-, trans-. 9H-purine, 6-hydrazino-9-(2-hydroxycyclohexyl)-, cis-. Hypoxanthine, 9-(2-hydroxycyclohexyl)-, trans. Hydrocodone. Dihydromorphine. Dihydromorphinone acetate. Senecionine, 12-acetyl. Adenosine, N-(trimethylsilyl)-2',3'-bis-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate]. Methyldihydromorphine. Hydromorphone. Eruciflorine. 21-Hydroxyintergerrimine. (E)-Eruciflorine.

Find more compounds similar to Cyclohexanol, 2-(9h-purin-9-yl)-, trans-.

Sources

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