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1677-49-2 | Quinoline, 2,4,7-trichloro-
CAS No: 1677-49-2 Catalog No: AG001XJL MDL No:MFCD00830403
Product Description
Catalog Number:
AG001XJL
Chemical Name:
Quinoline, 2,4,7-trichloro-
CAS Number:
1677-49-2
Molecular Formula:
C9H4Cl3N
Molecular Weight:
232.4938
MDL Number:
MFCD00830403
IUPAC Name:
2,4,7-trichloroquinoline
InChI:
InChI=1S/C9H4Cl3N/c10-5-1-2-6-7(11)4-9(12)13-8(6)3-5/h1-4H
InChI Key:
NIESTINBJGQKPB-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)nc(cc2Cl)Cl
NSC Number:
131496
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.941g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.488g/mol
Monoisotopic Mass:
230.941g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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