Home Halogens 2,4,6-Trichloropyrimidine-5-carboxylic acid

2,4,6-Trichloropyrimidine-5-carboxylic acid

CAS No.:
93416-51-4
Catalog Number:
AG0036QK
Molecular Formula:
C5HCl3N2O2
Molecular Weight:
227.4326
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$157
- +
5g
95%
In Stock USA
United States
$523
- +
Product Description
Catalog Number:
AG0036QK
Chemical Name:
2,4,6-Trichloropyrimidine-5-carboxylic acid
CAS Number:
93416-51-4
Molecular Formula:
C5HCl3N2O2
Molecular Weight:
227.4326
MDL Number:
MFCD09909820
IUPAC Name:
2,4,6-trichloropyrimidine-5-carboxylic acid
InChI:
InChI=1S/C5HCl3N2O2/c6-2-1(4(11)12)3(7)10-5(8)9-2/h(H,11,12)
InChI Key:
WYOSARQXNFQQIG-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(Cl)nc(nc1Cl)Cl
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.91g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.425g/mol
Monoisotopic Mass:
225.91g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties