1H,4H,5H,6H-pyrrolo[3,4-c]pyrazole


Chemical Name: 1H,4H,5H,6H-pyrrolo[3,4-c]pyrazole
CAS Number: 6573-19-9
Product Number: AG00FC28(AGN-PC-0WA4L8)
Synonyms:
MDL No:
Molecular Formula: C5H7N3
Molecular Weight: 109.1292

Identification/Properties


Computed Properties
Molecular Weight:
109.132g/mol
XLogP3:
-0.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
109.064g/mol
Monoisotopic Mass:
109.064g/mol
Topological Polar Surface Area:
40.7A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
93.7
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

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NMR Spectrum


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