| CAS Number | 1421601-86-6 |
| Catalog Number | AG01A08P(AGN-PC-0WBER5) |
| Chemical Name | 1-(2-fluoroethyl)-1H-pyrazole-4-carbaldehyde |
| IUPAC Name | 1-(2-fluoroethyl)pyrazole-4-carbaldehyde |
| InChI | InChI=1S/C6H7FN2O/c7-1-2-9-4-6(5-10)3-8-9/h3-5H,1-2H2 |
| InChI Key | HCPBSFSGWBGDQW-UHFFFAOYSA-N |
| MDL Number | MFCD22392007 |
| Molecular Formula | C6H7FN2O |
| Molecular Weight | 142.1310 |
| SMILES | FCCN1N=CC(C=O)=C1 |
| Synonyms | 1-(2-fluoroethyl)-1H-pyrazole-4-carbaldehyde,
1421601-86-6,
MFCD22392007,
ZINC82162739,
AKOS019262125,
1-(2-Fluoro-ethyl)-1H-pyrazole-4-carbaldehyde,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 142.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 142.133g/mol |
| Monoisotopic Mass | 142.054g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 34.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number