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18552-90-4

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18552-90-4 Structure

18552-90-4 Structure
IdentificationBack Directory
[Name]

2-Iodo-6-chloropurine
[CAS]

18552-90-4
[Synonyms]

6-Chloro-2-iodopurine
2-Iodo-6-chloropurine
6-chloro-2-iodo-9h-purine
6-Chloro-2-iodo-1H-purine
6-chloro-2-iodo-7H-purine
6-Chloro-2-iodopurine 97%
9H-Purine,6-chloro-2-iodo-
[Molecular Formula]

C5H2ClIN4
[MDL Number]

MFCD09753499
[MOL File]

18552-90-4.mol
[Molecular Weight]

280.45
Chemical PropertiesBack Directory
[Melting point ]

198-203°C
[Boiling point ]

296°C
[density ]

2.75
[Fp ]

133°C
[storage temp. ]

Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
[form ]

solid
[pka]

5.55±0.20(Predicted)
[Appearance]

White to off-white Solid
[InChI]

InChI=1S/C5H2ClIN4/c6-3-2-4(9-1-8-2)11-5(7)10-3/h1H,(H,8,9,10,11)
[InChIKey]

SZRNPDHDBPGZOA-UHFFFAOYSA-N
[SMILES]

N1C2C(=NC(I)=NC=2Cl)NC=1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P280-P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

22
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Uses]

6-Chloro-2-iodopurine is used as a reagent in the synthesis of MRS 2500 Tetraammonium Salt (M750200); a highly potent and selective antagonist of the platelet P2Y1 receptor that inhibits ADP-induced aggregation of human platelets. 6-Chloro-2-iodopurine is also used in the preparation of methanocarba disubstituted adenine nucleosides as highly potent and selective A3 adenosine receptor agonists.
Spectrum DetailBack Directory
[Spectrum Detail]

2-Iodo-6-chloropurine(18552-90-4)1HNMR
2-Iodo-6-chloropurine(18552-90-4)13CNMR
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