| CAS Number | 926218-66-8 |
| Catalog Number | AG00PSA8(AGN-PC-0WBPW0) |
| Chemical Name | 5-(2,5-dimethylfuran-3-yl)-1,3,4-oxadiazol-2-amine |
| IUPAC Name | 5-(2,5-dimethylfuran-3-yl)-1,3,4-oxadiazol-2-amine |
| InChI | InChI=1S/C8H9N3O2/c1-4-3-6(5(2)12-4)7-10-11-8(9)13-7/h3H,1-2H3,(H2,9,11) |
| InChI Key | YAKHQTKBLTVDPB-UHFFFAOYSA-N |
| MDL Number | MFCD09041623 |
| Molecular Formula | C8H9N3O2 |
| Molecular Weight | 179.1760 |
| SMILES | CC1OC(C)=C(C2OC(N)=NN=2)C=1 |
| Synonyms | 5-(2,5-dimethylfuran-3-yl)-1,3,4-oxadiazol-2-amine,
926218-66-8,
5-(2,5-dimethyl-3-furyl)-1,3,4-oxadiazol-2-amine,
AC1Q2GT1,
CTK7E1431,
DTXSID70588027,
AOD100762,
ZINC21949638,
AKOS000123681,
MCULE-3586939138,
EN300-66064,
L-4046,
F2158-1463,
Z1262398472,
|
| Complexity | 190 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.179g/mol |
| Monoisotopic Mass | 179.069g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 78.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number