tert-butyl 4-chloro-5,7-dihydropyrrolo[3,4-d]pyrimidine-6-carboxylate


Chemical Name: tert-butyl 4-chloro-5,7-dihydropyrrolo[3,4-d]pyrimidine-6-carboxylate
CAS Number: 1053657-15-0
Product Number: AG008Z2U(AGN-PC-0BKEQF)
Synonyms:
MDL No:
Molecular Formula: C11H14ClN3O2
Molecular Weight: 255.7008

Identification/Properties


Computed Properties
Molecular Weight:
255.702g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
255.077g/mol
Monoisotopic Mass:
255.077g/mol
Topological Polar Surface Area:
55.3A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
306
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


NMR Spectrum


Other Analytical Data


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