Chemical Properties of Purine, 6-aziridinyl-9-benzyl-8-chloro- (CAS 92291-24-2)

Purine, 6-aziridinyl-9-benzyl-8-chloro-

InChI
InChI=1S/C14H12ClN5/c15-14-18-11-12(19-6-7-19)16-9-17-13(11)20(14)8-10-4-2-1-3-5-10/h1-5,9H,6-8H2
InChI Key
RJZDHHLHTFYBIC-UHFFFAOYSA-N
Formula
C14H12ClN5
SMILES
Clc1nc2c(N3CC3)ncnc2n1Cc1ccccc1
Molecular Weight1
285.73
CAS
92291-24-2
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Physical Properties

Property Value Unit Source
ω 0.6693 Relay (1.0) Calculated Property
Δf 542.48 kJ/mol Relay (1.0-beta) Calculated Property
Δfgas 395.41 kJ/mol Relay (1.0) Calculated Property
Δvap 105.12 kJ/mol Relay (1.0) Calculated Property
IE 8.51 eV Relay (1.0) Calculated Property
log10WS -4.43 Relay (1.0) Calculated Property
logPoct/wat 2.348 Crippen Calculated Property
McVol 196.720 ml/mol McGowan Calculated Property
Pc 3094.90 kPa Relay (1.0-beta) Calculated Property
Tboil 669.64 K Relay (1.0) Calculated Property
Tc 1020.42 K Relay (1.0) Calculated Property
Tfus 464.31 K Relay (1.0) Calculated Property
Vc 0.778 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

9H-purine, 6-aziridinyl-9-benzyl-. 9H-purine, 6-aziridinyl-9-benzyl-2-chloro-. Ethanol, 2,2'-[(9-benzyl-9h-purin-6-yl)imino]di-. 9H-purine, 2-amino-6-aziridinyl-9-benzyl-. Quinine, trimethylsilyl ether. 21-Hydroxyintergerrimine. 3'-Deoxyguanosine, tris(trimethylsilyl) deriv.. risperidone. Senecionine, 12-acetyl. inosine-5'-monophosphate, TMS. cyclomegistine. 9H-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-, 2',3'-diacetate, 5'-bis(3,5-dimethylphenyl)phosphate. (E)-Eruciflorine. Acetylgynuramine. xanthosine-5'-monophosphate, TMS.

Find more compounds similar to Purine, 6-aziridinyl-9-benzyl-8-chloro-.

Sources

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