Home Carboxys Ethyl 2-(trifluoromethyl)quinoline-4-carboxylate

Ethyl 2-(trifluoromethyl)quinoline-4-carboxylate

CAS No.:
1185292-57-2
Catalog Number:
AG00812R
Molecular Formula:
C13H10F3NO2
Molecular Weight:
269.2192
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Product Description
Catalog Number:
AG00812R
Chemical Name:
Ethyl 2-(trifluoromethyl)quinoline-4-carboxylate
CAS Number:
1185292-57-2
Molecular Formula:
C13H10F3NO2
Molecular Weight:
269.2192
MDL Number:
MFCD12197296
IUPAC Name:
ethyl 2-(trifluoromethyl)quinoline-4-carboxylate
InChI:
InChI=1S/C13H10F3NO2/c1-2-19-12(18)9-7-11(13(14,15)16)17-10-6-4-3-5-8(9)10/h3-7H,2H2,1H3
InChI Key:
QVBSGRJRYFODRW-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(nc2c1cccc2)C(F)(F)F
Properties
Complexity:
332  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.066g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.223g/mol
Monoisotopic Mass:
269.066g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties