| CAS Number | 230972-02-8 |
| Catalog Number | AG00BJAD(AGN-PC-00P8OK) |
| Chemical Name | 1-(5-Morpholinothiophen-2-YL)ethanone |
| IUPAC Name | 1-(5-morpholin-4-ylthiophen-2-yl)ethanone |
| InChI | InChI=1S/C10H13NO2S/c1-8(12)9-2-3-10(14-9)11-4-6-13-7-5-11/h2-3H,4-7H2,1H3 |
| InChI Key | KGKILYSCKBSZBF-UHFFFAOYSA-N |
| MDL Number | MFCD09998269 |
| Molecular Formula | C10H13NO2S |
| Molecular Weight | 211.2807 |
| SMILES | CC(=O)C1=CC=C(S1)N1CCOCC1 |
| Synonyms | 1-(5-MORPHOLINOTHIOPHEN-2-YL)ETHANONE,
230972-02-8,
2-Morpholino-5-acetylthiophene,
SCHEMBL3127062,
CTK5J9695,
DTXSID30572765,
2-acetyl-5-morpholin-4-ylthiophene,
4579AH,
AR3446,
MFCD09998269,
ZINC16321980,
AKOS022671140,
MCULE-9582213833,
AS-45609,
ST51043901,
Ethanone, 1-[5-(4-morpholinyl)-2-thienyl]-,
1-[5-(Morpholin-4-yl)thiophen-2-yl]ethan-1-one,
C10H13NO2S,
1-[5-(4-morpholinyl)-2-thienyl]ethanone,
|
| Complexity | 216 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.279g/mol |
| Monoisotopic Mass | 211.067g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 57.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number