Home Halogens 6-chloro-8-(trifluoromethyl)-9H-purine

6-chloro-8-(trifluoromethyl)-9H-purine

CAS No.:
282522-06-9
Catalog Number:
AG00BNFA
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00BNFA
Chemical Name:
6-chloro-8-(trifluoromethyl)-9H-purine
CAS Number:
282522-06-9
MDL Number:
MFCD11977611
IUPAC Name:
6-chloro-8-(trifluoromethyl)-7H-purine
InChI:
InChI=1S/C6H2ClF3N4/c7-3-2-4(12-1-11-3)14-5(13-2)6(8,9)10/h1H,(H,11,12,13,14)
InChI Key:
NRTITYXDWXJYSH-UHFFFAOYSA-N
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.992g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.555g/mol
Monoisotopic Mass:
221.992g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties