| CAS Number | 1423042-49-2 |
| Catalog Number | AG01C3PP |
| Chemical Name | 5-chloro-3-cyclohexyl-1,2,4-thiadiazole |
| IUPAC Name | 5-chloro-3-cyclohexyl-1,2,4-thiadiazole |
| InChI | InChI=1S/C8H11ClN2S/c9-8-10-7(11-12-8)6-4-2-1-3-5-6/h6H,1-5H2 |
| InChI Key | XTQXHZULWITISY-UHFFFAOYSA-N |
| MDL Number | MFCD21190962 |
| Molecular Formula | C8H11ClN2S |
| Molecular Weight | 202.7043 |
| SMILES | ClC1SN=C(C2CCCCC2)N=1 |
| Synonyms | 5-chloro-3-cyclohexyl-1,2,4-thiadiazole,
1423042-49-2,
SCHEMBL14698860,
XTQXHZULWITISY-UHFFFAOYSA-N,
ZINC83646006,
AKOS014601903,
5-Chloro-3-cyclohexyl-[1,2,4]thiadiazole,
|
| Complexity | 150 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.033g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.7g/mol |
| Monoisotopic Mass | 202.033g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 54A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number