| CAS Number | 921760-69-2 |
| Catalog Number | AG0063Y2(AGN-PC-0BTYYE) |
| Chemical Name | 3-Pyridinecarbonitrile, 2-cyclopropyl- |
| IUPAC Name | 2-cyclopropylpyridine-3-carbonitrile |
| InChI | InChI=1S/C9H8N2/c10-6-8-2-1-5-11-9(8)7-3-4-7/h1-2,5,7H,3-4H2 |
| InChI Key | BXVQUHAHCVFATN-UHFFFAOYSA-N |
| MDL Number | MFCD18384486 |
| Molecular Formula | C9H8N2 |
| Molecular Weight | 144.1732 |
| SMILES | N#CC1=C(C2CC2)N=CC=C1 |
| Synonyms | 921760-69-2,
2-cyclopropylpyridine-3-carbonitrile,
2-cyclopropylnicotinonitrile,
3-Pyridinecarbonitrile, 2-cyclopropyl-,
2-cyclopropyl-3-cyano-pyridine,
SCHEMBL1812525,
CTK3G1453,
DTXSID30726468,
BXVQUHAHCVFATN-UHFFFAOYSA-N,
ZINC17940037,
AKOS026726804,
MCULE-2856325982,
NE49787,
DA-00985,
Z1649677765,
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| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 144.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.177g/mol |
| Monoisotopic Mass | 144.069g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 36.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number