Home Halogens 4-chloro-8-fluoro-2-methyl-3-(propan-2-yl)quinoline

4-chloro-8-fluoro-2-methyl-3-(propan-2-yl)quinoline

CAS No.:
1343392-03-9
Catalog Number:
AG01A64S
Molecular Formula:
C13H13ClFN
Molecular Weight:
237.7004
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Product Description
Catalog Number:
AG01A64S
Chemical Name:
4-chloro-8-fluoro-2-methyl-3-(propan-2-yl)quinoline
CAS Number:
1343392-03-9
Molecular Formula:
C13H13ClFN
Molecular Weight:
237.7004
MDL Number:
MFCD17246879
IUPAC Name:
4-chloro-8-fluoro-2-methyl-3-propan-2-ylquinoline
InChI:
InChI=1S/C13H13ClFN/c1-7(2)11-8(3)16-13-9(12(11)14)5-4-6-10(13)15/h4-7H,1-3H3
InChI Key:
RDFHWVKIABBZEX-UHFFFAOYSA-N
SMILES:
CC(c1c(C)nc2c(c1Cl)cccc2F)C
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.072g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.702g/mol
Monoisotopic Mass:
237.072g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  
Properties