| CAS Number | 1020945-92-9 |
| Catalog Number | AG019X6J(AGN-PC-0WO6DT) |
| Chemical Name | 3-Chloro-6-ethoxypyridine-2-carboxylic acid |
| IUPAC Name | 3-chloro-6-ethoxypyridine-2-carboxylic acid |
| InChI | InChI=1S/C8H8ClNO3/c1-2-13-6-4-3-5(9)7(10-6)8(11)12/h3-4H,2H2,1H3,(H,11,12) |
| InChI Key | GOTHCMYEHRDTBZ-UHFFFAOYSA-N |
| MDL Number | MFCD11147588 |
| Molecular Formula | C8H8ClNO3 |
| Molecular Weight | 201.6070 |
| SMILES | ClC=1C(=NC(=CC1)OCC)C(=O)O |
| Synonyms | 3-chloro-6-ethoxypyridine-2-carboxylic acid,
1020945-92-9,
CTK6G1548,
AC1Q3842,
ZINC19965715,
AKOS000246651,
MCULE-5079611448,
NE49586,
EN300-54183,
Z815264064,
|
| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.019g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.606g/mol |
| Monoisotopic Mass | 201.019g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 59.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number