Home Halogens Ethyl 4,8-dichloroquinoline-3-carboxylate

Ethyl 4,8-dichloroquinoline-3-carboxylate

CAS No.:
56824-91-0
Catalog Number:
AG00EJ3X
Molecular Formula:
C12H9Cl2NO2
Molecular Weight:
270.1114
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$41
- +
1g
95%
In Stock USA
United States
$82
- +
5g
95%
In Stock USA
United States
$246
- +
Product Description
Catalog Number:
AG00EJ3X
Chemical Name:
Ethyl 4,8-dichloroquinoline-3-carboxylate
CAS Number:
56824-91-0
Molecular Formula:
C12H9Cl2NO2
Molecular Weight:
270.1114
MDL Number:
MFCD00173351
IUPAC Name:
ethyl 4,8-dichloroquinoline-3-carboxylate
InChI:
InChI=1S/C12H9Cl2NO2/c1-2-17-12(16)8-6-15-11-7(10(8)14)4-3-5-9(11)13/h3-6H,2H2,1H3
InChI Key:
HINLPSGAVZPTIW-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnc2c(c1Cl)cccc2Cl
Properties
Complexity:
288  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.001g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.109g/mol
Monoisotopic Mass:
269.001g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties