Home Other Building Blocks 1-tert-butyl-6-hydrazinyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one

1-tert-butyl-6-hydrazinyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one

CAS No.:
1311316-36-5
Catalog Number:
AG01AH8G
Molecular Formula:
C9H14N6O
Molecular Weight:
222.2471
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Product Description
Catalog Number:
AG01AH8G
Chemical Name:
1-tert-butyl-6-hydrazinyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one
CAS Number:
1311316-36-5
Molecular Formula:
C9H14N6O
Molecular Weight:
222.2471
MDL Number:
MFCD18483243
IUPAC Name:
1-tert-butyl-6-hydrazinyl-5H-pyrazolo[3,4-d]pyrimidin-4-one
InChI:
InChI=1S/C9H14N6O/c1-9(2,3)15-6-5(4-11-15)7(16)13-8(12-6)14-10/h4H,10H2,1-3H3,(H2,12,13,14,16)
InChI Key:
VULVODLTEDSLAT-UHFFFAOYSA-N
SMILES:
NNc1[nH]c(=O)c2c(n1)n(nc2)C(C)(C)C
Properties
Complexity:
333  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.123g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
222.252g/mol
Monoisotopic Mass:
222.123g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
97.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties