| CAS Number | 3663-40-9 |
| Catalog Number | AG00C87U(AGN-PC-07HBW0) |
| Chemical Name | 3-Ethyl-1,2,4-oxadiazol-5-amine |
| IUPAC Name | 3-ethyl-1,2,4-oxadiazol-5-amine |
| InChI | InChI=1S/C4H7N3O/c1-2-3-6-4(5)8-7-3/h2H2,1H3,(H2,5,6,7) |
| InChI Key | HGPUJQWMCPURNO-UHFFFAOYSA-N |
| MDL Number | MFCD11847815 |
| Molecular Formula | C4H7N3O |
| Molecular Weight | 113.1179 |
| SMILES | N1C(CC)=NOC=1N |
| Synonyms | 3-ETHYL-1,2,4-OXADIAZOL-5-AMINE,
3663-40-9,
SCHEMBL91599,
DTXSID70672495,
MFCD11847815,
ZINC42384066,
AKOS011759752,
AS-48649,
SC-28961,
AJ-104329,
3-ethyl-1,2,4-oxadiazol-5-amine(SALTDATA,
Y-6884,
Z2211231619,
2-(7-hydroxy-2-oxo-2H-chromen-4-yl)acetamide,
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| Complexity | 77.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 113.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 113.12g/mol |
| Monoisotopic Mass | 113.059g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 64.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number