| CAS Number | 1881321-75-0 |
| Catalog Number | AG00I2EK(AGN-PC-0WR8MJ) |
| Chemical Name | 3-Chloro-2-(cyclopentyloxy)pyridin-4-ol |
| IUPAC Name | 3-chloro-2-cyclopentyloxy-1H-pyridin-4-one |
| InChI | InChI=1S/C10H12ClNO2/c11-9-8(13)5-6-12-10(9)14-7-3-1-2-4-7/h5-7H,1-4H2,(H,12,13) |
| InChI Key | VFCXYJMQSFOKRA-UHFFFAOYSA-N |
| MDL Number | MFCD29044601 |
| Molecular Formula | C10H12ClNO2 |
| Molecular Weight | 213.6608 |
| SMILES | Clc1c(O)ccnc1OC1CCCC1 |
| Synonyms | 3-CHLORO-2-(CYCLOPENTYLOXY)PYRIDIN-4-OL,
1881321-75-0,
ZINC261494337,
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| Complexity | 303 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 213.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 213.661g/mol |
| Monoisotopic Mass | 213.056g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
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Certificate of Analysis
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