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30831-78-8 | Ethanone, 1-(2-methoxy-1(2H)-quinolinyl)-
CAS No: 30831-78-8 Catalog No: AG0031FZ MDL No:
Product Description
Catalog Number:
AG0031FZ
Chemical Name:
Ethanone, 1-(2-methoxy-1(2H)-quinolinyl)-
CAS Number:
30831-78-8
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
IUPAC Name:
1-(2-methoxy-2H-quinolin-1-yl)ethanone
InChI:
InChI=1S/C12H13NO2/c1-9(14)13-11-6-4-3-5-10(11)7-8-12(13)15-2/h3-8,12H,1-2H3
InChI Key:
DNVWXCCXMJHGAD-UHFFFAOYSA-N
SMILES:
COC1C=Cc2c(N1C(=O)C)cccc2
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.241g/mol
Monoisotopic Mass:
203.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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