| CAS Number | 1588440-89-4 |
| Catalog Number | AG001QX2(AGN-PC-0WAN8W) |
| Chemical Name | 4-(Aminomethyl)-7-methoxy-3,4-dihydroquinolin-2(1H)-one hydrochloride |
| IUPAC Name | 4-(aminomethyl)-7-methoxy-3,4-dihydro-1H-quinolin-2-one;hydrochloride |
| InChI | InChI=1S/C11H14N2O2.ClH/c1-15-8-2-3-9-7(6-12)4-11(14)13-10(9)5-8;/h2-3,5,7H,4,6,12H2,1H3,(H,13,14);1H |
| InChI Key | ARGQJDKNZOLEHT-UHFFFAOYSA-N |
| MDL Number | MFCD27920873 |
| Molecular Formula | C11H15ClN2O2 |
| Molecular Weight | 242.7020 |
| SMILES | O=C1NC2=C(C=CC(OC)=C2)C(CN)C1.Cl |
| Synonyms | 4-(Aminomethyl)-7-methoxy-3,4-dihydroquinolin-2(1H)-one hydrochloride,
1588440-89-4,
AK144708,
MFCD27920873,
AKOS022186412,
DS-7946,
KS-00000S13,
ST2405406,
2(1H)-Quinolinone, 4-(aminomethyl)-3,4-dihydro-7-methoxy-, hydrochloride (1:1),
|
| Complexity | 245 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.082g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.703g/mol |
| Monoisotopic Mass | 242.082g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 64.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H332-H335
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Packing Group
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Precautionary statements
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P261-P280-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number