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Home > Aldehydes > 1015078-03-1
1015078-03-1 | 5-Quinolinecarboxaldehyde, 3-methyl-
CAS No: 1015078-03-1 Catalog No: AG0004O3 MDL No:
Product Description
Catalog Number:
AG0004O3
Chemical Name:
5-Quinolinecarboxaldehyde, 3-methyl-
CAS Number:
1015078-03-1
Molecular Formula:
C11H9NO
Molecular Weight:
171.1953
IUPAC Name:
3-methylquinoline-5-carbaldehyde
InChI:
InChI=1S/C11H9NO/c1-8-5-10-9(7-13)3-2-4-11(10)12-6-8/h2-7H,1H3
InChI Key:
ULYISZWCRLYCFR-UHFFFAOYSA-N
SMILES:
O=Cc1cccc2c1cc(C)cn2
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.068g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.199g/mol
Monoisotopic Mass:
171.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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