| CAS Number | 1260758-33-5 |
| Catalog Number | AG003ASC(AGN-PC-0WBRXQ) |
| Chemical Name | 2,6-Dichloro-5-fluoropyridine-3-carboxaldehyde |
| IUPAC Name | 2,6-dichloro-5-fluoropyridine-3-carbaldehyde |
| InChI | InChI=1S/C6H2Cl2FNO/c7-5-3(2-11)1-4(9)6(8)10-5/h1-2H |
| InChI Key | PVYGHERNXKCTOM-UHFFFAOYSA-N |
| MDL Number | MFCD15528788 |
| Molecular Formula | C6H2Cl2FNO |
| Molecular Weight | 193.9906 |
| SMILES | ClC1=C(C=O)C=C(C(=N1)Cl)F |
| Synonyms | 1260758-33-5,
2,6-Dichloro-5-fluoronicotinaldehyde,
2,6-Dichloro-5-fluoro-3-pyridinecarboxaldehyde,
2,6-Dichloro-5-fluoropyridine-3-carboxaldehyde,
2,6-dichloro-5-fluoropyridine-3-carbaldehyde,
SCHEMBL3939862,
BBL101844,
STL555641,
ZINC71256448,
AKOS008901393,
|
| Complexity | 158 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 192.95g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.986g/mol |
| Monoisotopic Mass | 192.95g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 30A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
6.1
|
|
Hazard statements
|
H301-H315-H319-H335
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P261-P301+P310-P305+P351+P338
|
|
UN Code
|
UN 2811
|
Certificate of Analysis
Lot Number