ChemicalBook--->CAS DataBase List--->21047-89-2

21047-89-2

21047-89-2 Structure

21047-89-2 Structure
IdentificationBack Directory
[Name]

Propanamide, N-(6,7-dihydro-6-oxo-1H-purin-2-yl)-2-methyl-
[CAS]

21047-89-2
[Synonyms]

2-N-isobutyrylguanine
N2- isobuttyryl guanine
N2-isobutyrylguanine (monohydrate)
N-(6-Oxo-6,7-dihydro-1H-purin-2-yl)
N-(6-Oxo-6,7-dihydro-1H-purin-2-yl)isobutyraMide
N-(6-oxo-6,9-dihydro-1H-purin-2-yl)isobutyraMide
"PropanaMide, N-(6,9-dihydro-6-oxo-1H-purin-2-yl)-
2-methyl-N-(6-oxo-3,7-dihydropurin-2-yl)propanamide
N-(6,7-Dihydro-6-oxo-1H-purin-2-yl)-2-methylpropanamide
Propanamide, N-(6,7-dihydro-6-oxo-1H-purin-2-yl)-2-methyl-
"PropanaMide, N-(6,9-dihydro-6-oxo-1H-purin-2-yl)-2-Methyl-
2-methyl-N-(6-oxo-3,7-dihydropurin-2-yl)propanamide,hydrate
[Molecular Formula]

C9H11N5O2
[MDL Number]

MFCD00831974
[MOL File]

21047-89-2.mol
[Molecular Weight]

221.22
Chemical PropertiesBack Directory
[Melting point ]

>300 °C
[density ]

1.61±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[pka]

9.15±0.20(Predicted)
[InChI]

InChI=1S/C9H11N5O2/c1-4(2)7(15)13-9-12-6-5(8(16)14-9)10-3-11-6/h3-4H,1-2H3,(H3,10,11,12,13,14,15,16)
[InChIKey]

CFIBTBBTJWHPQV-UHFFFAOYSA-N
[SMILES]

C(NC1NC(=O)C2=C(N=1)NC=N2)(=O)C(C)C
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Hazard InformationBack Directory
[Uses]

N-(6,7-Dihydro-6-oxo-1H-purin-2-yl)-2-methylpropanamide is applied in the enzymic transglycosylation of purine nucleobases in synthesis of purine nucleosides.
Spectrum DetailBack Directory
[Spectrum Detail]

Propanamide, N-(6,7-dihydro-6-oxo-1H-purin-2-yl)-2-methyl-(21047-89-2)1HNMR
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