1H-Purine, 6-chloro-


Chemical Name: 1H-Purine, 6-chloro-
CAS Number: 87-42-3
Product Number: AG0034CS(AGN-PC-0OL0K0)
Synonyms:
MDL No:
Molecular Formula: C5H3ClN4
Molecular Weight: 154.5571

Identification/Properties


Properties
MP:
>300 °C (dec.);(lit.);
BP:
449.6 °C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.8430 (estimate)
Solubility:
5 g/L
Computed Properties
Molecular Weight:
154.557g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
154.005g/mol
Monoisotopic Mass:
154.005g/mol
Topological Polar Surface Area:
54.5A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
131
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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