| CAS Number | 84163-80-4 |
| Catalog Number | AG01A57F(AGN-PC-0WO4DS) |
| Chemical Name | (7-Chloroquinolin-8-yl)methanol |
| IUPAC Name | (7-chloroquinolin-8-yl)methanol |
| InChI | InChI=1S/C10H8ClNO/c11-9-4-3-7-2-1-5-12-10(7)8(9)6-13/h1-5,13H,6H2 |
| InChI Key | GAXWGAXWVVGHHI-UHFFFAOYSA-N |
| MDL Number | MFCD24842811 |
| Molecular Formula | C10H8ClNO |
| Molecular Weight | 193.6296 |
| SMILES | ClC1=CC=C2C=CC=NC2=C1CO |
| Synonyms | (7-chloroquinolin-8-yl)methanol,
84163-80-4,
8-Quinolinemethanol, 7-chloro-,
SCHEMBL10548249,
ZINC95347589,
AKOS026727513,
NE54817,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.029g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.63g/mol |
| Monoisotopic Mass | 193.029g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 33.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
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Certificate of Analysis
Lot Number