| CAS Number | 862463-82-9 |
| Catalog Number | AG00IDZ3(AGN-PC-0NHZ44) |
| Chemical Name | 1-[(Thiophen-3-yl)carbonyl]piperidine |
| IUPAC Name | piperidin-1-yl(thiophen-3-yl)methanone |
| InChI | InChI=1S/C10H13NOS/c12-10(9-4-7-13-8-9)11-5-2-1-3-6-11/h4,7-8H,1-3,5-6H2 |
| InChI Key | QJPQSCIOXQVQGZ-UHFFFAOYSA-N |
| MDL Number | MFCD20355792 |
| Molecular Formula | C10H13NOS |
| Molecular Weight | 195.2813 |
| SMILES | O=C(c1cscc1)N1CCCCC1 |
| Synonyms | Piperidin-1-yl(thiophen-3-yl)methanone,
862463-82-9,
1-(3-Thienylcarbonyl)piperidine,
Piperidine, 1-(3-thienylcarbonyl)-,
ZINC38880002,
AKOS008982118,
1-[(Thiophen-3-yl)carbonyl]piperidine,
F6541-0881,
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| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.28g/mol |
| Monoisotopic Mass | 195.072g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 48.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
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