Home Halogens 6-chloro-4-methyl-1H-pyrazolo[3,4-d]pyrimidine dihydrochloride

6-chloro-4-methyl-1H-pyrazolo[3,4-d]pyrimidine dihydrochloride

CAS No.:
1864057-38-4
Catalog Number:
AG01BHJR
Molecular Formula:
C6H7Cl3N4
Molecular Weight:
241.5056
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Product Description
Catalog Number:
AG01BHJR
Chemical Name:
6-chloro-4-methyl-1H-pyrazolo[3,4-d]pyrimidine dihydrochloride
CAS Number:
1864057-38-4
Molecular Formula:
C6H7Cl3N4
Molecular Weight:
241.5056
MDL Number:
MFCD28145290
IUPAC Name:
6-chloro-4-methyl-1H-pyrazolo[3,4-d]pyrimidine;dihydrochloride
InChI:
InChI=1S/C6H5ClN4.2ClH/c1-3-4-2-8-11-5(4)10-6(7)9-3;;/h2H,1H3,(H,8,9,10,11);2*1H
InChI Key:
KRDZRWYXMJHKMR-UHFFFAOYSA-N
SMILES:
Clc1nc(C)c2c(n1)[nH]nc2.Cl.Cl
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.974g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
241.5g/mol
Monoisotopic Mass:
239.974g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties