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74693-57-5 | 2(1H)-Quinolinone, 4-(acetyloxy)-1-methyl-3-(2-(5-nitro-2-thienyl)ethe nyl)-
CAS No: 74693-57-5 Catalog No: AG00FSE9 MDL No:
Product Description
Catalog Number:
AG00FSE9
Chemical Name:
2(1H)-Quinolinone, 4-(acetyloxy)-1-methyl-3-(2-(5-nitro-2-thienyl)ethe nyl)-
CAS Number:
74693-57-5
IUPAC Name:
[1-methyl-3-[(E)-2-(5-nitrothiophen-2-yl)ethenyl]-2-oxoquinolin-4-yl] acetate
InChI:
InChI=1S/C18H14N2O5S/c1-11(21)25-17-13-5-3-4-6-15(13)19(2)18(22)14(17)9-7-12-8-10-16(26-12)20(23)24/h3-10H,1-2H3/b9-7+
InChI Key:
XVBCTPZAYISZDZ-VQHVLOKHSA-N
Properties
Complexity:
669
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
370.062g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
370.379g/mol
Monoisotopic Mass:
370.062g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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