| CAS Number | 845617-99-4 |
| Catalog Number | AG00G9XK(AGN-PC-0CTPKC) |
| Chemical Name | 3-Chloro-5-(trifluoromethyl)pyridazine |
| IUPAC Name | 3-chloro-5-(trifluoromethyl)pyridazine |
| InChI | InChI=1S/C5H2ClF3N2/c6-4-1-3(2-10-11-4)5(7,8)9/h1-2H |
| InChI Key | GEFXHRCGAYIERB-UHFFFAOYSA-N |
| MDL Number | MFCD20275278 |
| Molecular Formula | C5H2ClF3N2 |
| Molecular Weight | 182.5310 |
| SMILES | FC(C1=CC(Cl)=NN=C1)(F)F |
| Synonyms | 3-chloro-5-(trifluoromethyl)pyridazine,
845617-99-4,
SCHEMBL1692045,
CTK8E4435,
DTXSID70731430,
GEFXHRCGAYIERB-UHFFFAOYSA-N,
3-Chloro-5-trifluoromethylpyridazine,
MFCD20275278,
ZINC83428718,
3-Chloro-5-trifluoromethyl-pyridazine,
AKOS024260280,
QC-5255,
SB13710,
3-chloro-5-(trifluoromethyl)-Pyridazine,
AJ-125974,
TX-016717,
4CH-025107,
CS-0051410,
ST24042053,
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| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.986g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 182.53g/mol |
| Monoisotopic Mass | 181.986g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number