| CAS Number | 501917-22-2 |
| Catalog Number | AG018FNX(AGN-PC-0WBQ5R) |
| Chemical Name | 2-Chloro-5,6,7,8-tetrahydroquinolin-5-ol |
| IUPAC Name | 2-chloro-5,6,7,8-tetrahydroquinolin-5-ol |
| InChI | InChI=1S/C9H10ClNO/c10-9-5-4-6-7(11-9)2-1-3-8(6)12/h4-5,8,12H,1-3H2 |
| InChI Key | GSFRRRRSKPUSHE-UHFFFAOYSA-N |
| MDL Number | MFCD08692080 |
| Molecular Formula | C9H10ClNO |
| Molecular Weight | 183.6348 |
| SMILES | ClC1=NC(CCC2)=C(C=C1)C2O |
| Synonyms | 2-chloro-5,6,7,8-tetrahydroquinolin-5-ol,
501917-22-2,
SCHEMBL868299,
GSFRRRRSKPUSHE-UHFFFAOYSA-N,
AKOS005208285,
MCULE-7863437064,
5-Quinolinol, 2-chloro-5,6,7,8-tetrahydro-,
L-3767,
F2124-0309,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.635g/mol |
| Monoisotopic Mass | 183.045g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 33.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number