| CAS Number | 1215206-19-1 |
| Catalog Number | AG00155W(AGN-PC-0WA4V3) |
| Chemical Name | 2-((4-Iodo-1H-pyrazol-1-YL)methyl)pyridine |
| IUPAC Name | 2-[(4-iodopyrazol-1-yl)methyl]pyridine |
| InChI | InChI=1S/C9H8IN3/c10-8-5-12-13(6-8)7-9-3-1-2-4-11-9/h1-6H,7H2 |
| InChI Key | MMOKTRJYBYNYDX-UHFFFAOYSA-N |
| MDL Number | MFCD15143572 |
| Molecular Formula | C9H8IN3 |
| Molecular Weight | 285.0844 |
| SMILES | Ic1cnn(c1)Cc1ccccn1 |
| Synonyms | 2-((4-IODO-1H-PYRAZOL-1-YL)METHYL)PYRIDINE,
1215206-19-1,
2-[(4-Iodo-1H-pyrazol-1-yl)methyl]pyridine,
ACMC-209acy,
CTK4B2458,
DTXSID60682028,
ANW-17696,
MFCD15143572,
ZINC65337175,
AKOS013754741,
TR-034576,
Z8385,
A-5470,
Pyridine, 2-[(4-iodo-1H-pyrazol-1-yl)methyl]-,
I02-3507,
C9H8IN3,
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| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 284.976g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 285.088g/mol |
| Monoisotopic Mass | 284.976g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 30.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number