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159383-54-7 | Quinoline, 2-chloro-3-(3-chloropropyl)-
CAS No: 159383-54-7 Catalog No: AG001QNE MDL No:
Product Description
Catalog Number:
AG001QNE
Chemical Name:
Quinoline, 2-chloro-3-(3-chloropropyl)-
CAS Number:
159383-54-7
Molecular Formula:
C12H11Cl2N
Molecular Weight:
240.1284
IUPAC Name:
2-chloro-3-(3-chloropropyl)quinoline
InChI:
InChI=1S/C12H11Cl2N/c13-7-3-5-10-8-9-4-1-2-6-11(9)15-12(10)14/h1-2,4,6,8H,3,5,7H2
InChI Key:
QCYHXZIFBMOXLP-UHFFFAOYSA-N
SMILES:
ClCCCc1cc2ccccc2nc1Cl
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.027g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.127g/mol
Monoisotopic Mass:
239.027g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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