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140908-89-0 | Quinoline, 4-chloro-2-methyl-8-(trifluoromethyl)-
CAS No: 140908-89-0 Catalog No: AG001CZ9 MDL No:
Product Description
Catalog Number:
AG001CZ9
Chemical Name:
Quinoline, 4-chloro-2-methyl-8-(trifluoromethyl)-
CAS Number:
140908-89-0
Molecular Formula:
C11H7ClF3N
Molecular Weight:
245.6282
IUPAC Name:
4-chloro-2-methyl-8-(trifluoromethyl)quinoline
InChI:
InChI=1S/C11H7ClF3N/c1-6-5-9(12)7-3-2-4-8(10(7)16-6)11(13,14)15/h2-5H,1H3
InChI Key:
FHGWTLJPECDLOJ-UHFFFAOYSA-N
SMILES:
Cc1cc(Cl)c2c(n1)c(ccc2)C(F)(F)F
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.022g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.629g/mol
Monoisotopic Mass:
245.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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