| CAS Number | 1337246-46-4 |
| Catalog Number | AG01A2UB(AGN-PC-0WOB0A) |
| Chemical Name | 1-(4-Amino-3,4-dihydroquinolin-1(2H)-yl)ethanone |
| IUPAC Name | 1-(4-amino-3,4-dihydro-2H-quinolin-1-yl)ethanone |
| InChI | InChI=1S/C11H14N2O/c1-8(14)13-7-6-10(12)9-4-2-3-5-11(9)13/h2-5,10H,6-7,12H2,1H3 |
| InChI Key | UBTOHKCMZLCVOK-UHFFFAOYSA-N |
| MDL Number | MFCD20295712 |
| Molecular Formula | C11H14N2O |
| Molecular Weight | 190.2417 |
| SMILES | CC(N1C2=C(C=CC=C2)C(N)CC1)=O |
| Synonyms | 1-(4-amino-1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one,
1337246-46-4,
SCHEMBL14275844,
AKOS013632985,
NE52934,
1-(4-Amino-3,4-dihydroquinolin-1(2H)-yl)ethanone,
Z1891776554,
|
| Complexity | 229 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.246g/mol |
| Monoisotopic Mass | 190.111g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
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Certificate of Analysis
Lot Number