| CAS Number | 42443-04-9 |
| Catalog Number | AG01ECIA(AGN-PC-0WD5VI) |
| Chemical Name | 1-(6-Hydroxy-3,4-dihydroquinolin-1(2H)-yl)ethanone |
| IUPAC Name | 1-(6-hydroxy-3,4-dihydro-2H-quinolin-1-yl)ethanone |
| InChI | InChI=1S/C11H13NO2/c1-8(13)12-6-2-3-9-7-10(14)4-5-11(9)12/h4-5,7,14H,2-3,6H2,1H3 |
| InChI Key | LVLHMCKNLKOGLT-UHFFFAOYSA-N |
| MDL Number | MFCD24715584 |
| Molecular Formula | C11H13NO2 |
| Molecular Weight | 191.2264 |
| SMILES | CC(N1C2=C(C=C(C=C2)O)CCC1)=O |
| Synonyms | 1-(6-Hydroxy-3,4-dihydroquinolin-1(2H)-yl)ethanone,
42443-04-9,
SCHEMBL6721657,
LVLHMCKNLKOGLT-UHFFFAOYSA-N,
ZINC34200478,
AKOS022189670,
FCH2036539,
AJ-87413,
AX8287369,
1-acetyl-1,2,3,4-tetrahydro-6-hydroxyquinoline,
1-acetyl-6-hydroxy-1,2,3,4-tetrahydroquinoline,
1-(3,4-dihydro-6-hydroxy-1(2H)-quinolinyl)Ethanone,
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| Complexity | 229 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.23g/mol |
| Monoisotopic Mass | 191.095g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number