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132118-51-5 | Quinoline, 2,7-dichloro-3-ethyl-
CAS No: 132118-51-5 Catalog No: AG00108Q MDL No:
Product Description
Catalog Number:
AG00108Q
Chemical Name:
Quinoline, 2,7-dichloro-3-ethyl-
CAS Number:
132118-51-5
Molecular Formula:
C11H9Cl2N
Molecular Weight:
226.1019
IUPAC Name:
2,7-dichloro-3-ethylquinoline
InChI:
InChI=1S/C11H9Cl2N/c1-2-7-5-8-3-4-9(12)6-10(8)14-11(7)13/h3-6H,2H2,1H3
InChI Key:
CPMBFXPQWNYBMB-UHFFFAOYSA-N
SMILES:
CCc1cc2ccc(cc2nc1Cl)Cl
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.011g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.1g/mol
Monoisotopic Mass:
225.011g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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