Home Halogens 9-[(2,4-dichlorophenyl)methyl]-9H-purin-6-amine

9-[(2,4-dichlorophenyl)methyl]-9H-purin-6-amine

CAS No.:
213528-01-9
Catalog Number:
AG01EJH0
Molecular Formula:
C12H9Cl2N5
Molecular Weight:
294.1394
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Product Description
Catalog Number:
AG01EJH0
Chemical Name:
9-[(2,4-dichlorophenyl)methyl]-9H-purin-6-amine
CAS Number:
213528-01-9
Molecular Formula:
C12H9Cl2N5
Molecular Weight:
294.1394
MDL Number:
MFCD19449597
IUPAC Name:
9-[(2,4-dichlorophenyl)methyl]purin-6-amine
InChI:
InChI=1S/C12H9Cl2N5/c13-8-2-1-7(9(14)3-8)4-19-6-18-10-11(15)16-5-17-12(10)19/h1-3,5-6H,4H2,(H2,15,16,17)
InChI Key:
FRXAPZNMESXULU-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)Cn1cnc2c1ncnc2N
Properties
Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.024g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
294.139g/mol
Monoisotopic Mass:
293.024g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties