Home Other Building Blocks 2-Chloro-6-methyl-9h-purine

2-Chloro-6-methyl-9h-purine

CAS No.:
1681-19-2
Catalog Number:
AG001XTC
Molecular Formula:
C6H5ClN4
Molecular Weight:
168.5837
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Product Description
Catalog Number:
AG001XTC
Chemical Name:
2-Chloro-6-methyl-9h-purine
CAS Number:
1681-19-2
Molecular Formula:
C6H5ClN4
Molecular Weight:
168.5837
MDL Number:
MFCD09756840
IUPAC Name:
2-chloro-6-methyl-7H-purine
InChI:
InChI=1S/C6H5ClN4/c1-3-4-5(9-2-8-4)11-6(7)10-3/h2H,1H3,(H,8,9,10,11)
InChI Key:
GSWWRXJYHSJFHJ-UHFFFAOYSA-N
SMILES:
Clc1nc(C)c2c(n1)[nH]cn2
NSC Number:
17823
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.02g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
168.584g/mol
Monoisotopic Mass:
168.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties