6-(Aminomethyl)-3,4-dihydro-2(1H)-quinolinone - CAS 933726-66-0
Catalog: |
BB074380 |
Product Name: |
6-(Aminomethyl)-3,4-dihydro-2(1H)-quinolinone |
CAS: |
933726-66-0 |
Synonyms: |
6-(Aminomethyl)-3,4-dihydroquinolin-2(1H)-one; 6-(aminomethyl)-3,4-dihydro-1H-quinolin-2-one |
IUPAC Name: | 6-(aminomethyl)-3,4-dihydro-1H-quinolin-2-one |
Molecular Weight: | 176.22 |
Molecular Formula: | C10H12N2O |
Canonical SMILES: | C1CC(=O)NC2=C1C=C(C=C2)CN |
InChI: | InChI=1S/C10H12N2O/c11-6-7-1-3-9-8(5-7)2-4-10(13)12-9/h1,3,5H,2,4,6,11H2,(H,12,13) |
InChI Key: | KBEANBKVUMVUFJ-UHFFFAOYSA-N |
Complexity: | 205 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 176.094963011 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 176.094963011 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 55.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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