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Home > Quinoline > 1505668-16-5
1505668-16-5 | 1-acetyl-6-ethoxy-1,2,3,4-tetrahydroquinolin-4-one
CAS No: 1505668-16-5 Catalog No: AG01BVWU MDL No:MFCD30476534
Product Description
Catalog Number:
AG01BVWU
Chemical Name:
1-acetyl-6-ethoxy-1,2,3,4-tetrahydroquinolin-4-one
CAS Number:
1505668-16-5
Molecular Formula:
C13H15NO3
Molecular Weight:
233.2631
MDL Number:
MFCD30476534
IUPAC Name:
1-acetyl-6-ethoxy-2,3-dihydroquinolin-4-one
InChI:
InChI=1S/C13H15NO3/c1-3-17-10-4-5-12-11(8-10)13(16)6-7-14(12)9(2)15/h4-5,8H,3,6-7H2,1-2H3
InChI Key:
VRYPLNYBBZPKNC-UHFFFAOYSA-N
SMILES:
CCOc1ccc2c(c1)C(=O)CCN2C(=O)C
Properties
Complexity:
316
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.105g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.267g/mol
Monoisotopic Mass:
233.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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