| CAS Number | 478148-53-7 |
| Catalog Number | AG00IL9A(AGN-PC-03JLMB) |
| Chemical Name | 7-chlorofuro[2,3-c]pyridine-5-carboxylic acid |
| IUPAC Name | 7-chlorofuro[2,3-c]pyridine-5-carboxylic acid |
| InChI | InChI=1S/C8H4ClNO3/c9-7-6-4(1-2-13-6)3-5(10-7)8(11)12/h1-3H,(H,11,12) |
| InChI Key | PXTZUYPPAYUOEY-UHFFFAOYSA-N |
| MDL Number | MFCD18259880 |
| Molecular Formula | C8H4ClNO3 |
| Molecular Weight | 197.5753 |
| SMILES | OC(=O)C1=NC(Cl)=C2OC=CC2=C1 |
| Synonyms | 7-chlorofuro[2,3-c]pyridine-5-carboxylic acid,
478148-53-7,
SCHEMBL844102,
PXTZUYPPAYUOEY-UHFFFAOYSA-N,
AS-54361,
CS-0050040,
Furo[2,3-c]pyridine-5-carboxylic acid, 7-chloro-,
|
| Complexity | 223 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.987971g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.57g/mol |
| Monoisotopic Mass | 196.987971g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 63.3Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number