| CAS Number | 1015846-78-2 |
| Catalog Number | AG0004WM(AGN-PC-0WB59X) |
| Chemical Name | 2-(3-Ethyl-1,2,4-oxadiazol-5-YL)aniline |
| IUPAC Name | 2-(3-ethyl-1,2,4-oxadiazol-5-yl)aniline |
| InChI | InChI=1S/C10H11N3O/c1-2-9-12-10(14-13-9)7-5-3-4-6-8(7)11/h3-6H,2,11H2,1H3 |
| InChI Key | URCSOIPMLRVRLU-UHFFFAOYSA-N |
| MDL Number | MFCD09971316 |
| Molecular Formula | C10H11N3O |
| Molecular Weight | 189.2138 |
| SMILES | C1(ON=C(CC)N=1)C1C=CC=CC=1N |
| Synonyms | 2-(3-ETHYL-1,2,4-OXADIAZOL-5-YL)ANILINE,
1015846-78-2,
CTK3J9989,
DTXSID50651021,
MFCD09971316,
ZINC19093173,
AKOS009228025,
MCULE-1337397368,
AJ-72051,
Y-6220,
Benzenamine, 2-(3-ethyl-1,2,4-oxadiazol-5-yl)-,
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| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.218g/mol |
| Monoisotopic Mass | 189.09g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 64.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
Lot Number