| CAS Number | 391864-00-9 |
| Catalog Number | AG00760H(AGN-PC-0WB55N) |
| Chemical Name | 2-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)propanamide |
| IUPAC Name | 2-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)propanamide |
| InChI | InChI=1S/C7H10ClN3OS/c1-3-5-10-11-7(13-5)9-6(12)4(2)8/h4H,3H2,1-2H3,(H,9,11,12) |
| InChI Key | OTRRQPRHLHNAKR-UHFFFAOYSA-N |
| MDL Number | MFCD04409256 |
| Molecular Formula | C7H10ClN3OS |
| Molecular Weight | 219.6918 |
| SMILES | C1(=NN=C(CC)S1)NC(C(C)Cl)=O |
| Synonyms | 2-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)propanamide,
391864-00-9,
AC1N9QLN,
CTK4I1053,
DTXSID10403023,
CHEMBRDG-BB 9071611,
MFCD04409256,
AKOS000103886,
AKOS016158795,
MCULE-1437458380,
Y-1320,
AB00667935-01,
SR-01000006259,
SR-01000006259-1,
F0453-0271,
CHEMBRDG-BB9071611,
ZINC04079100,
CID4414824,
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| Complexity | 193 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.023g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.687g/mol |
| Monoisotopic Mass | 219.023g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 83.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number