| CAS Number | 926226-84-8 |
| Catalog Number | AG019U6G(AGN-PC-0WOBOH) |
| Chemical Name | [3-(thiophen-3-yl)-1,2,4-oxadiazol-5-yl]methanol |
| IUPAC Name | (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methanol |
| InChI | InChI=1S/C7H6N2O2S/c10-3-6-8-7(9-11-6)5-1-2-12-4-5/h1-2,4,10H,3H2 |
| InChI Key | HPARLKVFEDBTSJ-UHFFFAOYSA-N |
| MDL Number | MFCD08442376 |
| Molecular Formula | C7H6N2O2S |
| Molecular Weight | 182.1997 |
| SMILES | OCC1ON=C(C2=CSC=C2)N=1 |
| Synonyms | [3-(thiophen-3-yl)-1,2,4-oxadiazol-5-yl]methanol,
(3-THIEN-3-YL-1,2,4-OXADIAZOL-5-YL)METHANOL,
926226-84-8,
(3-(thiophen-3-yl)-1,2,4-oxadiazol-5-yl)methanol,
CTK8A3525,
ZINC21951533,
AKOS000125293,
MCULE-1872674124,
NE30291,
|
| Complexity | 158 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 182.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 182.197g/mol |
| Monoisotopic Mass | 182.015g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 87.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
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Certificate of Analysis
Lot Number