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Home Carboxys 4-Chloro-7-(trifluoromethoxy)quinoline-3-carboxylic acid ethyl ester

4-Chloro-7-(trifluoromethoxy)quinoline-3-carboxylic acid ethyl ester

CAS No.:
890841-23-3
Catalog Number:
AG00IFKP
Molecular Formula:
C13H9ClF3NO3
Molecular Weight:
319.6637
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
In Stock USA
United States
$582
- +
2.5g
In Stock USA
United States
$991
- +
5g
In Stock USA
United States
$1491
- +
10g
In Stock USA
United States
$2248
- +
25g
In Stock USA
United States
$3880
- +
Product Description
Catalog Number:
AG00IFKP
Chemical Name:
4-Chloro-7-(trifluoromethoxy)quinoline-3-carboxylic acid ethyl ester
CAS Number:
890841-23-3
Molecular Formula:
C13H9ClF3NO3
Molecular Weight:
319.6637
MDL Number:
MFCD16987428
IUPAC Name:
ethyl 4-chloro-7-(trifluoromethoxy)quinoline-3-carboxylate
InChI:
InChI=1S/C13H9ClF3NO3/c1-2-20-12(19)9-6-18-10-5-7(21-13(15,16)17)3-4-8(10)11(9)14/h3-6H,2H2,1H3
InChI Key:
XQRIHVPOLQTQIZ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnc2c(c1Cl)ccc(c2)OC(F)(F)F
Properties
Complexity:
380  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.022g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.664g/mol
Monoisotopic Mass:
319.022g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Properties