| CAS Number | 234444-66-7 |
| Catalog Number | AG00I4K4(AGN-PC-0WOAVE) |
| Chemical Name | 7-Chloroquinoline-2-carboxylic acid |
| IUPAC Name | 7-chloroquinoline-2-carboxylic acid |
| InChI | InChI=1S/C10H6ClNO2/c11-7-3-1-6-2-4-8(10(13)14)12-9(6)5-7/h1-5H,(H,13,14) |
| InChI Key | JCGLRGUFLQNLIE-UHFFFAOYSA-N |
| MDL Number | MFCD11108692 |
| Molecular Formula | C10H6ClNO2 |
| Molecular Weight | 207.6131 |
| SMILES | C1=CC(=CC2=C1C=CC(=N2)C(=O)O)Cl |
| Synonyms | 7-CHLOROQUINOLINE-2-CARBOXYLIC ACID,
234444-66-7,
7-Chloro-2-quinolinecarboxylic acid,
7-chloroquinoline-2-carboxylic,
MFCD11108692,
ZINC26474817,
AKOS022491840,
2-Quinolinecarboxylic acid, 7-chloro-,
MCULE-7879826256,
NE20300,
AS-40483,
SC-31248,
Z1362754556,
|
| Complexity | 234 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.009g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.613g/mol |
| Monoisotopic Mass | 207.009g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 50.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number