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Home > Aldehydes > 101382-56-3
101382-56-3 | 3-Quinolinecarboxaldehyde, 1,2-dihydro-6,7-dimethoxy-2-oxo-
CAS No: 101382-56-3 Catalog No: AG0004CV MDL No:MFCD07506517
Product Description
Catalog Number:
AG0004CV
Chemical Name:
3-Quinolinecarboxaldehyde, 1,2-dihydro-6,7-dimethoxy-2-oxo-
CAS Number:
101382-56-3
Molecular Formula:
C12H11NO4
Molecular Weight:
233.2200
MDL Number:
MFCD07506517
IUPAC Name:
6,7-dimethoxy-2-oxo-1H-quinoline-3-carbaldehyde
InChI:
InChI=1S/C12H11NO4/c1-16-10-4-7-3-8(6-14)12(15)13-9(7)5-11(10)17-2/h3-6H,1-2H3,(H,13,15)
InChI Key:
HTIOQXCYAQEVAR-UHFFFAOYSA-N
SMILES:
COc1cc2[nH]c(=O)c(cc2cc1OC)C=O
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.069g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.223g/mol
Monoisotopic Mass:
233.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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