Chemical Properties of 1H-Purin-6-amine, N,N-dimethyl- (CAS 938-55-6)

InChI

InChI=1S/C7H9N5/c1-12(2)7-5-6(9-3-8-5)10-4-11-7/h3-4H,1-2H3,(H,8,9,10,11)

InChI Key

BVIAOQMSVZHOJM-UHFFFAOYSA-N

Formula

C7H9N5

SMILES

CN(C)c1ncnc2[nH]cnc12

Molecular Weight¹

163.18

CAS

938-55-6

Other Names

• Adenine, N,N-dimethyl-
• 6-(Dimethylamino)purine
• N(6),N(6)-Dimethyladenine
• N,N-Dimethyladenine
• 6-Dimethyladenine
• Dimethyladenine
• N,N-Dimethyl-6-aminopurine
• Purine, 6-(dimethylamino)-
• Adenine, N6,N6-dimethyl-
• 6-Dimethylamino-9H-purine
• NSC 401568
• Dimethylaminopurine

• Δ_subH : Enthalpy of sublimation at a given temperature (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
IE	7.78	eV	NIST
log10WS	-1.70		Crippen Calculated Property
logPoct/wat	-0.063		Crippen Calculated Property
McVol	120.470	ml/mol	McGowan Calculated Property
Inp	[1804.00; 1878.20]
Inp	1804.00		NIST
Inp	1878.20		NIST
Inp	1878.20		NIST

Temperature Dependent Properties

Similar Compounds

Find more compounds similar to 1H-Purin-6-amine, N,N-dimethyl-.

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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