Home Halogens 4,6-Dichloropyrimidine-2-carboxylic acid

4,6-Dichloropyrimidine-2-carboxylic acid

CAS No.:
684220-30-2
Catalog Number:
AG0036TW
Molecular Formula:
C5H2Cl2N2O2
Molecular Weight:
192.9876
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Product Description
Catalog Number:
AG0036TW
Chemical Name:
4,6-Dichloropyrimidine-2-carboxylic acid
CAS Number:
684220-30-2
Molecular Formula:
C5H2Cl2N2O2
Molecular Weight:
192.9876
MDL Number:
MFCD09834770
IUPAC Name:
4,6-dichloropyrimidine-2-carboxylic acid
InChI:
InChI=1S/C5H2Cl2N2O2/c6-2-1-3(7)9-4(8-2)5(10)11/h1H,(H,10,11)
InChI Key:
XTPRJRYOVQDBID-UHFFFAOYSA-N
SMILES:
OC(=O)c1nc(Cl)cc(n1)Cl
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.949g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
192.983g/mol
Monoisotopic Mass:
191.949g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties