9H-Purine, 2,6-dichloro-9-(1-methylethyl)-


Chemical Name: 9H-Purine, 2,6-dichloro-9-(1-methylethyl)-
CAS Number: 203436-45-7
Product Number: AG0028W1(AGN-PC-004LTG)
Synonyms:
MDL No:
Molecular Formula: C8H8Cl2N4
Molecular Weight: 231.0819

Identification/Properties


Computed Properties
Molecular Weight:
231.08g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
230.013g/mol
Monoisotopic Mass:
230.013g/mol
Topological Polar Surface Area:
43.6A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
214
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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