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2291-40-9 | 2,3,4(1H)-Quinolinetrione, 1-methyl-
CAS No: 2291-40-9 Catalog No: AG002LGU MDL No:MFCD22055652
Product Description
Catalog Number:
AG002LGU
Chemical Name:
2,3,4(1H)-Quinolinetrione, 1-methyl-
CAS Number:
2291-40-9
Molecular Formula:
C10H7NO3
Molecular Weight:
189.1675
MDL Number:
MFCD22055652
IUPAC Name:
1-methylquinoline-2,3,4-trione
InChI:
InChI=1S/C10H7NO3/c1-11-7-5-3-2-4-6(7)8(12)9(13)10(11)14/h2-5H,1H3
InChI Key:
YSOGCTYJXNGLQS-UHFFFAOYSA-N
SMILES:
O=C1C(=O)c2ccccc2N(C1=O)C
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.043g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.17g/mol
Monoisotopic Mass:
189.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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