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Home Halogens 4,5-Dichloro-7H-pyrrolo[2,3-d]pyrimidine

4,5-Dichloro-7H-pyrrolo[2,3-d]pyrimidine

CAS No.:
115093-90-8
Catalog Number:
AG000FW7
Molecular Formula:
C6H3Cl2N3
Molecular Weight:
188.0141
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$25
- +
5g
95%
In Stock USA
United States
$63
- +
25g
95%
In Stock USA
United States
$225
- +
100g
95%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG000FW7
Chemical Name:
4,5-Dichloro-7H-pyrrolo[2,3-d]pyrimidine
CAS Number:
115093-90-8
Molecular Formula:
C6H3Cl2N3
Molecular Weight:
188.0141
MDL Number:
MFCD09999173
IUPAC Name:
4,5-dichloro-7H-pyrrolo[2,3-d]pyrimidine
InChI:
InChI=1S/C6H3Cl2N3/c7-3-1-9-6-4(3)5(8)10-2-11-6/h1-2H,(H,9,10,11)
InChI Key:
VFTPONHUNNOSKG-UHFFFAOYSA-N
SMILES:
Clc1c[nH]c2c1c(Cl)ncn2
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.97g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
188.011g/mol
Monoisotopic Mass:
186.97g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
5-Chloro-N-[2-(1H-imidazol-4-yl)eth-yl]-N-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine. Acta crystallographica. Section E, Structure reports online 20100101
Properties