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182050-39-1 | Quinoline, 2,7-dichloro-3-(2-nitroethenyl)-
CAS No: 182050-39-1 Catalog No: AG0023A2 MDL No:
Product Description
Catalog Number:
AG0023A2
Chemical Name:
Quinoline, 2,7-dichloro-3-(2-nitroethenyl)-
CAS Number:
182050-39-1
Molecular Formula:
C11H6Cl2N2O2
Molecular Weight:
269.0835
IUPAC Name:
2,7-dichloro-3-(2-nitroethenyl)quinoline
InChI:
InChI=1S/C11H6Cl2N2O2/c12-9-2-1-7-5-8(3-4-15(16)17)11(13)14-10(7)6-9/h1-6H
InChI Key:
PCCHCBLCCVOVDN-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)C=Cc1cc2ccc(cc2nc1Cl)Cl
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.981g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.081g/mol
Monoisotopic Mass:
267.981g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4
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