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89446-54-8 | 7-Quinolinecarboxaldehyde, 2-methoxy-4-methyl-
CAS No: 89446-54-8 Catalog No: AG0088GF MDL No:
Product Description
Catalog Number:
AG0088GF
Chemical Name:
7-Quinolinecarboxaldehyde, 2-methoxy-4-methyl-
CAS Number:
89446-54-8
Molecular Formula:
C12H11NO2
Molecular Weight:
201.2212
IUPAC Name:
2-methoxy-4-methylquinoline-7-carbaldehyde
InChI:
InChI=1S/C12H11NO2/c1-8-5-12(15-2)13-11-6-9(7-14)3-4-10(8)11/h3-7H,1-2H3
InChI Key:
QMDXRYCMICAMOW-UHFFFAOYSA-N
SMILES:
COc1cc(C)c2c(n1)cc(cc2)C=O
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.225g/mol
Monoisotopic Mass:
201.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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