| CAS Number | 1152532-43-8 |
| Catalog Number | AG019N4G |
| Chemical Name | 5-(1-Chloroethyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole |
| IUPAC Name | 5-(1-chloroethyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole |
| InChI | InChI=1S/C10H8Cl2N2O/c1-6(11)10-13-9(14-15-10)7-2-4-8(12)5-3-7/h2-6H,1H3 |
| InChI Key | YVIPAQAGSSUVOB-UHFFFAOYSA-N |
| MDL Number | MFCD10693627 |
| Molecular Formula | C10H8Cl2N2O |
| Molecular Weight | 243.0893 |
| SMILES | CC(C1ON=C(C2=CC=C(Cl)C=C2)N=1)Cl |
| Synonyms | 5-(1-chloroethyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole,
1152532-43-8,
SCHEMBL11199479,
STL302002,
AKOS005205131,
MCULE-8497258870,
NE30219,
EN300-39378,
|
| Complexity | 210 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.001g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.087g/mol |
| Monoisotopic Mass | 242.001g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number