| CAS Number | 41248-08-2 |
| Catalog Number | AG00J2ON(AGN-PC-002GXR) |
| Chemical Name | 5-chloro-N,N-dimethyl-1,2,4-thiadiazol-3-amine |
| IUPAC Name | 5-chloro-N,N-dimethyl-1,2,4-thiadiazol-3-amine |
| InChI | InChI=1S/C4H6ClN3S/c1-8(2)4-6-3(5)9-7-4/h1-2H3 |
| InChI Key | CUTXHPVVEVMARX-UHFFFAOYSA-N |
| MDL Number | MFCD21185967 |
| Molecular Formula | C4H6ClN3S |
| Molecular Weight | 163.6285 |
| SMILES | N1=C(Cl)SN=C1N(C)C |
| Synonyms | 5-chloro-N,N-dimethyl-1,2,4-thiadiazol-3-amine,
41248-08-2,
SCHEMBL8806586,
ALBB-031339,
MFCD21185967,
ZINC34361496,
AKOS014603414,
DA-06020,
FT-0702146,
Y-8432,
|
| Complexity | 99.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 162.997g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 163.623g/mol |
| Monoisotopic Mass | 162.997g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 57.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number