| CAS Number | 145383-72-8 |
| Catalog Number | AG00AN7V(AGN-PC-02PRB3) |
| Chemical Name | 4-Chloro-5-cyanothiazole |
| IUPAC Name | 4-chloro-1,3-thiazole-5-carbonitrile |
| InChI | InChI=1S/C4HClN2S/c5-4-3(1-6)8-2-7-4/h2H |
| InChI Key | FNBXWKKRGNMGQJ-UHFFFAOYSA-N |
| MDL Number | MFCD18822128 |
| Molecular Formula | C4HClN2S |
| Molecular Weight | 144.5821 |
| SMILES | ClC1=C(C#N)SC=N1 |
| Synonyms | 145383-72-8,
4-chloro-5-cyanothiazole,
4-chlorothiazole-5-carbonitrile,
4-chloro-1,3-thiazole-5-carbonitrile,
5-Thiazolecarbonitrile, 4-chloro-,
SCHEMBL859617,
CTK8G9827,
5-Thiazolecarbonitrile, 4-chloro-,
ZINC39134712,
AKOS024048917,
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| Complexity | 129 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 143.955g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.576g/mol |
| Monoisotopic Mass | 143.955g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 64.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number