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67735-60-8 | 1-Methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde
CAS No: 67735-60-8 Catalog No: AG005QBB MDL No:MFCD06738236
Product Description
Catalog Number:
AG005QBB
Chemical Name:
1-Methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde
CAS Number:
67735-60-8
Molecular Formula:
C11H9NO2
Molecular Weight:
187.1947
MDL Number:
MFCD06738236
IUPAC Name:
1-methyl-2-oxoquinoline-3-carbaldehyde
InChI:
InChI=1S/C11H9NO2/c1-12-10-5-3-2-4-8(10)6-9(7-13)11(12)14/h2-7H,1H3
InChI Key:
AWJCCKYFFMSHCJ-UHFFFAOYSA-N
SMILES:
O=Cc1cc2ccccc2n(c1=O)C
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.063g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.198g/mol
Monoisotopic Mass:
187.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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