Chemical Properties of 9H-Purine, 6-chloro-9-(methoxymethyl)- (CAS 6504-64-9)

9H-Purine, 6-chloro-9-(methoxymethyl)-

InChI
InChI=1S/C7H7ClN4O/c1-13-4-12-3-11-5-6(8)9-2-10-7(5)12/h2-3H,4H2,1H3
InChI Key
SZLMRHFSYVCXQX-UHFFFAOYSA-N
Formula
C7H7ClN4O
SMILES
COCn1cnc2c(Cl)ncnc21
Molecular Weight1
198.61
CAS
6504-64-9
Other Names
  • 6-Chloro-9-methoxymethylpurine
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Physical Properties

Property Value Unit Source
ω 0.5453 Relay (1.0) Calculated Property
ΔfG° 273.02 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 67.83 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 78.67 kJ/mol Relay (1.0) Calculated Property
IE 9.15 eV Relay (1.0) Calculated Property
log10WS -1.79 Relay (1.0) Calculated Property
logPoct/wat 1.084 Crippen Calculated Property
McVol 128.600 ml/mol McGowan Calculated Property
Pc 4023.24 kPa Relay (1.0-beta) Calculated Property
Tboil 574.16 K Relay (1.0) Calculated Property
Tc 863.62 K Relay (1.0) Calculated Property
Tfus 409.21 K Relay (1.0) Calculated Property
Vc 0.497 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

2-[(2-aminopurin-9-yl)methoxy]ethanol. Acetamide, 6(9h)-chloropurine-9-yl-. 9H-purine, 6-chloro-9-ethyl-. 9H-purine, 6-chloro-9-(2-chloroethyl)-. Acyclovir. 9H-purine-9-ethanol, 6-chloro-, acetate. 2-Propanol, 3-(6-chloro-9h-purin-9-yl)-1-(n,n-diethylamino)-. 9H-purine-9-acetic acid, 6-chloro-, ethyl ester. O,O'-Bis(tert-butyldimethylsilyl) ,2-trimethylsilylamino-9-(2-hydroxyethoxymethyl)-purin-6-ol ether. 9H-purine, 6-chloro-2,9-diethyl. O,O'-Bis(tert-butyldimethylsilyl) 2-amino-9-(2-hydroxyethoxymethyl)-purin-6-ol ether. 7H-Purine, 7-benzyl-2,6-dichloro-. Hypoxanthine, 1-allyl-9-benzyl-. Ethanol, 2,2'-[(9-benzyl-9h-purin-6-yl)imino]di-. 9H-purine, 6-chloro-9-(beta-d-ribofuranosyl)-.

Find more compounds similar to 9H-Purine, 6-chloro-9-(methoxymethyl)-.

Sources

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