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169126-00-5 | 3-Quinolinecarboxaldehyde, 2-chloro-7-ethyl-
CAS No: 169126-00-5 Catalog No: AG001YHM MDL No:
Product Description
Catalog Number:
AG001YHM
Chemical Name:
3-Quinolinecarboxaldehyde, 2-chloro-7-ethyl-
CAS Number:
169126-00-5
Molecular Formula:
C12H10ClNO
Molecular Weight:
219.6669
IUPAC Name:
2-chloro-7-ethylquinoline-3-carbaldehyde
InChI:
InChI=1S/C12H10ClNO/c1-2-8-3-4-9-6-10(7-15)12(13)14-11(9)5-8/h3-7H,2H2,1H3
InChI Key:
QJGNUBYABNVQKB-UHFFFAOYSA-N
SMILES:
CCc1ccc2c(c1)nc(c(c2)C=O)Cl
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.045g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.668g/mol
Monoisotopic Mass:
219.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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