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Home Other Building Blocks 2-Chloro-6-methoxypurine

2-Chloro-6-methoxypurine

CAS No.:
1198-46-5
Catalog Number:
AG000PNU
Molecular Formula:
C6H5ClN4O
Molecular Weight:
184.5831
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95+%
1 week
United States
$31
- +
250mg
95+%
1 week
United States
$46
- +
Product Description
Catalog Number:
AG000PNU
Chemical Name:
2-Chloro-6-methoxypurine
CAS Number:
1198-46-5
Molecular Formula:
C6H5ClN4O
Molecular Weight:
184.5831
MDL Number:
MFCD20692004
IUPAC Name:
2-chloro-6-methoxy-7H-purine
InChI:
InChI=1S/C6H5ClN4O/c1-12-5-3-4(9-2-8-3)10-6(7)11-5/h2H,1H3,(H,8,9,10,11)
InChI Key:
MTDSMFYWSAISJR-UHFFFAOYSA-N
SMILES:
COc1nc(Cl)nc2c1nc[nH]2
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.015g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.583g/mol
Monoisotopic Mass:
184.015g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Literature
Title Journal
6-Oxo and 6-thio purine analogs as antimycobacterial agents. Bioorganic & medicinal chemistry 20130401
Properties