| CAS Number | 893735-01-8 |
| Catalog Number | AG007J81(AGN-PC-03X87F) |
| Chemical Name | Methyl 5-(thiophen-2-yl)pyridine-3-carboxylate |
| IUPAC Name | methyl 5-thiophen-2-ylpyridine-3-carboxylate |
| InChI | InChI=1S/C11H9NO2S/c1-14-11(13)9-5-8(6-12-7-9)10-3-2-4-15-10/h2-7H,1H3 |
| InChI Key | RDFRFBDTMUDSRT-UHFFFAOYSA-N |
| MDL Number | MFCD06802198 |
| Molecular Formula | C11H9NO2S |
| Molecular Weight | 219.2597 |
| SMILES | O=C(OC)C1=CN=CC(C2=CC=CS2)=C1 |
| Synonyms | Methyl 5-(thiophen-2-yl)nicotinate,
893735-01-8,
Methyl 5-(thiophen-2-yl)pyridine-3-carboxylate,
ACMC-209r06,
CTK8B2612,
DTXSID90629582,
ANW-39268,
KM2828,
MFCD06802198,
ZINC22201026,
AKOS004116529,
RL05614,
AJ-81273,
AX8230186,
TC-128013,
4CH-004928,
ST24025398,
V8798,
J-522419,
C11H9NO2S,
Methyl5-(thiophen-2-yl)nicotinate,
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| Complexity | 235 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.258g/mol |
| Monoisotopic Mass | 219.035g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 67.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number