Pyrazolo[1,5-a]pyrimidine-3-carbonitrile - CAS 25939-87-1
Catalog: |
BB050504 |
Product Name: |
Pyrazolo[1,5-a]pyrimidine-3-carbonitrile |
CAS: |
25939-87-1 |
Synonyms: |
pyrazolo(1,5-a)-pyrimidine-3-carbonitrile |
IUPAC Name: | pyrazolo[1,5-a]pyrimidine-3-carbonitrile |
Description: | Pyrazolo[1,5-a]pyrimidine-3-carbonitrile (CAS# 25939-87-1 ) is a useful research chemical. |
Molecular Weight: | 144.13 |
Molecular Formula: | C7H4N4 |
Canonical SMILES: | C1=CN2C(=C(C=N2)C#N)N=C1 |
InChI: | InChI=1S/C7H4N4/c8-4-6-5-10-11-3-1-2-9-7(6)11/h1-3,5H |
InChI Key: | RRHORVAOECWFPT-UHFFFAOYSA-N |
Boiling Point: | 1.4±0.1 g/cm3 |
Purity: | 97 % |
Density: | 1.37±0.1 g/cm3(Predicted) |
MDL: | MFCD01927799 |
Complexity: | 194 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 144.043596145 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 144.043596145 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 54 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
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