Home Other Building Blocks 1H-Purine-2,6-dione, 3,7-dihydro-3,7-dimethyl-

1H-Purine-2,6-dione, 3,7-dihydro-3,7-dimethyl-

CAS No.:
519-41-5
Catalog Number:
AG00E08O
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00E08O
Chemical Name:
1H-Purine-2,6-dione, 3,7-dihydro-3,7-dimethyl-
CAS Number:
519-41-5
MDL Number:
MFCD00022830
IUPAC Name:
3,7-dimethylpurine-2,6-dione;2-hydroxybenzoic acid
InChI:
InChI=1S/C7H8N4O2.C7H6O3/c1-10-3-8-5-4(10)6(12)9-7(13)11(5)2;8-6-4-2-1-3-5(6)7(9)10/h3H,1-2H3,(H,9,12,13);1-4,8H,(H,9,10)
InChI Key:
USCRSNRNIPAWGZ-UHFFFAOYSA-N
Properties
Complexity:
400  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.096g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
318.289g/mol
Monoisotopic Mass:
318.096g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties