| CAS Number | 937633-19-7 |
| Catalog Number | AG00IHTO(AGN-PC-0WNLYU) |
| Chemical Name | 2-(Chloromethyl)-5-(2,4-difluorophenyl)-1,3,4-oxadiazole |
| IUPAC Name | 2-(chloromethyl)-5-(2,4-difluorophenyl)-1,3,4-oxadiazole |
| InChI | InChI=1S/C9H5ClF2N2O/c10-4-8-13-14-9(15-8)6-2-1-5(11)3-7(6)12/h1-3H,4H2 |
| InChI Key | SUFHNHWSKBLQSF-UHFFFAOYSA-N |
| MDL Number | MFCD09051401 |
| Molecular Formula | C9H5ClF2N2O |
| Molecular Weight | 230.5986 |
| SMILES | Fc1ccc(-c2nnc(CCl)o2)c(F)c1 |
| Synonyms | 2-(CHLOROMETHYL)-5-(2,4-DIFLUOROPHENYL)-1,3,4-OXADIAZOLE,
937633-19-7,
CTK6H7039,
MFCD09051401,
ZINC22152917,
AKOS000134629,
AS-9372,
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| Complexity | 222 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.006g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.599g/mol |
| Monoisotopic Mass | 230.006g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
Lot Number