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1923846-51-8 | Cyclohexaneacetic acid, 4-(6-fluoro-4-quinolinyl)-, cis-
CAS No: 1923846-51-8 Catalog No: AG002FWF MDL No:
Product Description
Catalog Number:
AG002FWF
Chemical Name:
Cyclohexaneacetic acid, 4-(6-fluoro-4-quinolinyl)-, cis-
CAS Number:
1923846-51-8
Molecular Formula:
C17H18FNO2
Molecular Weight:
287.3287
IUPAC Name:
2-[4-(6-fluoroquinolin-4-yl)cyclohexyl]acetic acid
InChI:
InChI=1S/C17H18FNO2/c18-13-5-6-16-15(10-13)14(7-8-19-16)12-3-1-11(2-4-12)9-17(20)21/h5-8,10-12H,1-4,9H2,(H,20,21)
InChI Key:
GIPGFZGEPQMULK-UHFFFAOYSA-N
SMILES:
OC(=O)C[C@@H]1CC[C@@H](CC1)c1ccnc2c1cc(F)cc2
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.132g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
287.334g/mol
Monoisotopic Mass:
287.132g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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