2-(5-Cyclopropyl-1-methyl-1H-pyrazol-3-yl)acetonitrile - CAS 1225882-74-5
Catalog: |
BB051959 |
Product Name: |
2-(5-Cyclopropyl-1-methyl-1H-pyrazol-3-yl)acetonitrile |
CAS: |
1225882-74-5 |
Synonyms: |
(5-Cyclopropyl-1-methyl-1H-pyrazol-3-yl)acetonitrile |
IUPAC Name: | 2-(5-cyclopropyl-1-methylpyrazol-3-yl)acetonitrile |
Molecular Weight: | 161.20 |
Molecular Formula: | C9H11N3 |
Canonical SMILES: | CN1C(=CC(=N1)CC#N)C2CC2 |
InChI: | InChI=1S/C9H11N3/c1-12-9(7-2-3-7)6-8(11-12)4-5-10/h6-7H,2-4H2,1H3 |
InChI Key: | QFDIVXYYQNEJRT-UHFFFAOYSA-N |
Complexity: | 213 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 161.095297364 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 161.095297364 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 41.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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