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391-77-5 | 4-Chloro-6-fluoroquinoline
CAS No: 391-77-5 Catalog No: AG0038R3 MDL No:MFCD00278783
Product Description
Catalog Number:
AG0038R3
Chemical Name:
4-Chloro-6-fluoroquinoline
CAS Number:
391-77-5
Molecular Formula:
C9H5ClFN
Molecular Weight:
181.5941
MDL Number:
MFCD00278783
IUPAC Name:
4-chloro-6-fluoroquinoline
InChI:
InChI=1S/C9H5ClFN/c10-8-3-4-12-9-2-1-6(11)5-7(8)9/h1-5H
InChI Key:
CKTQPWIDUQGUGG-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)c(Cl)ccn2
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.009g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.594g/mol
Monoisotopic Mass:
181.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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