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Home Carboxys ethyl 8-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylate

ethyl 8-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylate

CAS No.:
31602-18-3
Catalog Number:
AG00CMNL
Molecular Formula:
C13H12F3NO2
Molecular Weight:
271.2351
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Product Description
Catalog Number:
AG00CMNL
Chemical Name:
ethyl 8-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylate
CAS Number:
31602-18-3
Molecular Formula:
C13H12F3NO2
Molecular Weight:
271.2351
MDL Number:
MFCD25542358
IUPAC Name:
ethyl 8-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylate
InChI:
InChI=1S/C13H12F3NO2/c1-2-19-12(18)9-6-8-4-3-5-10(13(14,15)16)11(8)17-7-9/h3-5,7,17H,2,6H2,1H3
InChI Key:
ARZJITASPSUNLM-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1=CNc2c(C1)cccc2C(F)(F)F
Properties
Complexity:
379  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.082g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
271.239g/mol
Monoisotopic Mass:
271.082g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties