| CAS Number | 959237-67-3 |
| Catalog Number | AG005WHK(AGN-PC-05BIGO) |
| Chemical Name | 2-Methoxy-6,7-Dihydro-5H-Cyclopenta[B]Pyridine-3-Carboxylic Acid |
| IUPAC Name | 2-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxylic acid |
| InChI | InChI=1S/C10H11NO3/c1-14-9-7(10(12)13)5-6-3-2-4-8(6)11-9/h5H,2-4H2,1H3,(H,12,13) |
| InChI Key | KYIDUKKOMMQHMY-UHFFFAOYSA-N |
| MDL Number | MFCD09864315 |
| Molecular Formula | C10H11NO3 |
| Molecular Weight | 193.1992 |
| SMILES | O(C)c1nc2c(cc1C(=O)O)CCC2 |
| Synonyms | 959237-67-3,
2-Methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxylic acid,
CTK5H8354,
DTXSID30650870,
MFCD09864315,
ZINC19089893,
AKOS011996289,
AJ-71294,
DA-18717,
FT-0743217,
Y-5711,
2-methoxy-5H,6H,7H-cyclopenta[b]pyridine-3-carboxylic acid,
2-Methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxylic acid, AldrichCPR,
2-METHOXY-6,7-DIHYDRO-5H-CYCLOPENTA[B]PYRIDINE-3-CARBOXYLICACID,
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| Complexity | 231 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.202g/mol |
| Monoisotopic Mass | 193.074g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 59.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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