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Home > Quinoline > 828277-17-4
828277-17-4 | 2(1H)-Quinolinone, 4-(methoxymethyl)-6-methyl-7-(2-propynyloxy)-
CAS No: 828277-17-4 Catalog No: AG0055P8 MDL No:
Product Description
Catalog Number:
AG0055P8
Chemical Name:
2(1H)-Quinolinone, 4-(methoxymethyl)-6-methyl-7-(2-propynyloxy)-
CAS Number:
828277-17-4
Molecular Formula:
C15H15NO3
Molecular Weight:
257.2845
IUPAC Name:
4-(methoxymethyl)-6-methyl-7-prop-2-ynoxy-1H-quinolin-2-one
InChI:
InChI=1S/C15H15NO3/c1-4-5-19-14-8-13-12(6-10(14)2)11(9-18-3)7-15(17)16-13/h1,6-8H,5,9H2,2-3H3,(H,16,17)
InChI Key:
UNINJLQNVFHZHA-UHFFFAOYSA-N
SMILES:
COCc1cc(=O)[nH]c2c1cc(C)c(c2)OCC#C
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.105g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
257.289g/mol
Monoisotopic Mass:
257.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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