Home Halogens 2,4-Dichloropyrimidine

2,4-Dichloropyrimidine

CAS No.:
3934-20-1
Catalog Number:
AG0032ZA
Molecular Formula:
C4H2Cl2N2
Molecular Weight:
148.9781
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$25
- +
100g
98%
In Stock USA
United States
$63
- +
500g
98%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG0032ZA
Chemical Name:
2,4-Dichloropyrimidine
CAS Number:
3934-20-1
Molecular Formula:
C4H2Cl2N2
Molecular Weight:
148.9781
MDL Number:
MFCD00006061
IUPAC Name:
2,4-dichloropyrimidine
InChI:
InChI=1S/C4H2Cl2N2/c5-3-1-2-7-4(6)8-3/h1-2H
InChI Key:
BTTNYQZNBZNDOR-UHFFFAOYSA-N
SMILES:
Clc1ccnc(n1)Cl
EC Number:
223-508-6
UNII:
YV96122OCD
Properties
Complexity:
78.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.96g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.974g/mol
Monoisotopic Mass:
147.96g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
Chemistry-based risk assessment for skin sensitization: quantitative mechanistic modeling for the S(N)Ar domain. Chemical research in toxicology 20110718
4,6-Dichloro-5-(2-meth-oxy-phen-oxy)-2,2'-bipyrimidine. Acta crystallographica. Section E, Structure reports online 20110601
N-(2-Chloro-pyrimidin-4-yl)-2-methyl-2H-indazol-6-amine methanol monosolvate. Acta crystallographica. Section E, Structure reports online 20110601
Molecular structure, harmonic and anharmonic frequency calculations of 2,4-dichloropyrimidine and 4,6-dichloropyrimidine by HF and density functional methods. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20110501
Synthesis and antitumor activity of novel ribonucleosides with C-5 OH replaced by a diaminopyrimidinyl group. Bioorganic & medicinal chemistry letters 20110201
Synthesis and characterization of novel 2, 2'-bipyrimidine fluorescent derivative for protein binding. Chemistry Central journal 20110101
Unusual radical addition on a heteroaromatic nitrogen. A convenient access to new pyrimidine derivatives. Chemical communications (Cambridge, England) 20100821
2,4-Dichloro-pyrimidine. Acta crystallographica. Section E, Structure reports online 20090601
Probing cell-division phenotype space and Polo-like kinase function using small molecules. Nature chemical biology 20061101
An efficient route to 4-aryl-5-pyrimidinylimidazoles via sequential functionalization of 2,4-dichloropyrimidine. Organic letters 20060119
Properties