Home Halogens 3,5-Dichloroisonicotinic acid

3,5-Dichloroisonicotinic acid

CAS No.:
13958-93-5
Catalog Number:
AG001BAY
Molecular Formula:
C6H3Cl2NO2
Molecular Weight:
191.9995
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$19
- +
5g
98%
In Stock USA
United States
$57
- +
10g
98%
In Stock USA
United States
$94
- +
25g
98%
In Stock USA
United States
$188
- +
100g
98%
In Stock USA
United States
$573
- +
Product Description
Catalog Number:
AG001BAY
Chemical Name:
3,5-Dichloroisonicotinic acid
CAS Number:
13958-93-5
Molecular Formula:
C6H3Cl2NO2
Molecular Weight:
191.9995
MDL Number:
MFCD01861975
IUPAC Name:
3,5-dichloropyridine-4-carboxylic acid
InChI:
InChI=1S/C6H3Cl2NO2/c7-3-1-9-2-4(8)5(3)6(10)11/h1-2H,(H,10,11)
InChI Key:
BUQPTOSHKHYHHB-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(Cl)cncc1Cl
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.954g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.995g/mol
Monoisotopic Mass:
190.954g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
8-Azatetracyclines: synthesis and evaluation of a novel class of tetracycline antibacterial agents. Journal of medicinal chemistry 20110310
Properties