| CAS Number | 374554-75-3 |
| Catalog Number | AG01AREA(AGN-PC-0WCN4R) |
| Chemical Name | 4-Chloro-6-(thiophen-2-yl)pyrimidine |
| IUPAC Name | 4-chloro-6-thiophen-2-ylpyrimidine |
| InChI | InChI=1S/C8H5ClN2S/c9-8-4-6(10-5-11-8)7-2-1-3-12-7/h1-5H |
| InChI Key | WISVYBFTUYSGNO-UHFFFAOYSA-N |
| MDL Number | MFCD09861717 |
| Molecular Formula | C8H5ClN2S |
| Molecular Weight | 196.6567 |
| SMILES | ClC1=NC=NC(C2SC=CC=2)=C1 |
| Synonyms | 4-chloro-6-(thiophen-2-yl)pyrimidine,
374554-75-3,
4-Chloro-6-thiophen-2-yl-pyrimidine,
SCHEMBL1445236,
WISVYBFTUYSGNO-UHFFFAOYSA-N,
4-(2-Thienyl)-6-chloropyrimidine,
4-chloro-6-(2-thienyl)pyrimidine,
ZINC26420741,
AKOS005208331,
MCULE-5583698564,
L-3798,
F1967-0503,
4-chloro-6-thiophen-2-ylpyrimidine,
|
| Complexity | 156 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.986g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.652g/mol |
| Monoisotopic Mass | 195.986g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 54A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number