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1701-24-2 | 4-Chloro-2-trifluoromethylquinoline
CAS No: 1701-24-2 Catalog No: AG003L2J MDL No:MFCD00153105
Product Description
Catalog Number:
AG003L2J
Chemical Name:
4-Chloro-2-trifluoromethylquinoline
CAS Number:
1701-24-2
Molecular Formula:
C10H5ClF3N
Molecular Weight:
231.6016
MDL Number:
MFCD00153105
IUPAC Name:
4-chloro-2-(trifluoromethyl)quinoline
InChI:
InChI=1S/C10H5ClF3N/c11-7-5-9(10(12,13)14)15-8-4-2-1-3-6(7)8/h1-5H
InChI Key:
ONNDFDQMHCNEGF-UHFFFAOYSA-N
SMILES:
Clc1cc(nc2c1cccc2)C(F)(F)F
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.006g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.602g/mol
Monoisotopic Mass:
231.006g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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