Chemical Properties of 9H-purine, 6-chloro-9-ethyl- (CAS 5462-86-2)

9H-purine, 6-chloro-9-ethyl-

InChI
InChI=1S/C7H7ClN4/c1-2-12-4-11-5-6(8)9-3-10-7(5)12/h3-4H,2H2,1H3
InChI Key
YSKHRCGNQFWRFM-UHFFFAOYSA-N
Formula
C7H7ClN4
SMILES
CCn1cnc2c(Cl)ncnc21
Molecular Weight1
182.61
CAS
5462-86-2
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Physical Properties

Property Value Unit Source
ω 0.4928 Relay (1.0) Calculated Property
Δf 336.16 kJ/mol Relay (1.0-beta) Calculated Property
Δfgas 169.21 kJ/mol Relay (1.0) Calculated Property
Δvap 74.67 kJ/mol Relay (1.0) Calculated Property
IE 9.03 eV Relay (1.0) Calculated Property
log10WS -2.47 Relay (1.0) Calculated Property
logPoct/wat 1.500 Crippen Calculated Property
McVol 122.730 ml/mol McGowan Calculated Property
Pc 4342.10 kPa Relay (1.0-beta) Calculated Property
Tboil 557.43 K Relay (1.0) Calculated Property
Tc 856.05 K Relay (1.0) Calculated Property
Tfus 407.96 K Relay (1.0) Calculated Property
Vc 0.480 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

9H-purine, 6-chloro-9-(2-chloroethyl)-. 9H-purine-9-ethanol, 6-chloro-, acetate. Acetamide, 6(9h)-chloropurine-9-yl-. 9H-purine, 6-chloro-2,9-diethyl. 9H-purine-9-acetic acid, 6-chloro-, ethyl ester. 9H-purin-6(1h)-one, 9-ethyl-. 9H-purine, 9-ethyl-6-hydrazino-. 9H-purine-6(1h)-one, 2-amino-9-ethyl-. 9H-purine, 9-butyl-. Adenine, 9-butyl-. 2-Propanol, 3-(6-chloro-9h-purin-9-yl)-1-(n,n-diethylamino)-. Acetamide, 9h-purine-9-yl. 9H-Purine, 6-chloro-9-(methoxymethyl)-. Urea, 1-[2-(6-hydroxy-9h-purin-9-yl)ethyl]-3-methyl-. Urea, 1-methyl-3-[2-[6-(methylthio)-9h-purin-9-yl]ethyl]-.

Find more compounds similar to 9H-purine, 6-chloro-9-ethyl-.

Sources

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