8-Azaadenine , 98% , 1123-54-2

CAS NO.：1123-54-2

Empirical Formula: C4H4N6

Molecular Weight: 136.11

MDL number: MFCD00005697

EINECS: 214-375-5

PRODUCT Properties

• Melting point: >300 °C(lit.)
• Boiling point: 240.36°C (rough estimate)
• Density: 1.3184 (rough estimate)
• refractive index: 1.8750 (estimate)
• storage temp.: Keep in dark place,Inert atmosphere,2-8°C
• solubility: DMSO (Slightly), Methanol (Very Slightly, Heated, Sonicated)
• pka: 12.81±0.20(Predicted)
• form: Solid
• color: White to Off-White
• InChI: InChI=1S/C4H4N6/c5-3-2-4(7-1-6-3)9-10-8-2/h1H,(H3,5,6,7,8,9,10)
• InChIKey: HRYKDUPGBWLLHO-UHFFFAOYSA-N
• SMILES: C1=NC(N)=C2N=NNC2=N1
• CAS DataBase Reference: 1123-54-2(CAS DataBase Reference)
• NIST Chemistry Reference: 8-Azaadenine(1123-54-2)
• EPA Substance Registry System: 1H-1,2,3-Triazolo[4,5-d]pyrimidin-7-amine (1123-54-2)

Description and Uses

8-Azaadenine is a useful reagent in developing acyclic nucleotide analogs derived from 8-Azapurines.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H315-H319-H335
• Precautionary statements: P261-P305+P351+P338
• WGK Germany: 3
• RTECS: XZ5680000
• F: 10-23
• TSCA: TSCA listed
• HazardClass: IRRITANT
• HS Code: 2933998090
• Toxicity: mouse,LD50,intraperitoneal,315mg/kg (315mg/kg),Pharmaceutical Chemistry Journal Vol. 11, Pg. 224, 1977.