Home Halogens Ethyl 4-chloro-8-cyanoquinoline-3-carboxylate

Ethyl 4-chloro-8-cyanoquinoline-3-carboxylate

CAS No.:
77173-67-2
Catalog Number:
AG003QAB
Molecular Formula:
C13H9ClN2O2
Molecular Weight:
260.6758
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$184
- +
Product Description
Catalog Number:
AG003QAB
Chemical Name:
Ethyl 4-chloro-8-cyanoquinoline-3-carboxylate
CAS Number:
77173-67-2
Molecular Formula:
C13H9ClN2O2
Molecular Weight:
260.6758
MDL Number:
MFCD00173414
IUPAC Name:
ethyl 4-chloro-8-cyanoquinoline-3-carboxylate
InChI:
InChI=1S/C13H9ClN2O2/c1-2-18-13(17)10-7-16-12-8(6-15)4-3-5-9(12)11(10)14/h3-5,7H,2H2,1H3
InChI Key:
MHOFAUCLSGVKOH-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnc2c(c1Cl)cccc2C#N
Properties
Complexity:
365  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.035g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.677g/mol
Monoisotopic Mass:
260.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties