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89271-05-6 | 1H-Purin-6-amine, 2,3-dihydro-1,3-dimethyl-
CAS No: 89271-05-6 Catalog No: AG0041C2 MDL No:
Product Description
Catalog Number:
AG0041C2
Chemical Name:
1H-Purin-6-amine, 2,3-dihydro-1,3-dimethyl-
CAS Number:
89271-05-6
Molecular Formula:
C7H11N5
Molecular Weight:
165.1957
IUPAC Name:
1,3-dimethyl-2,7-dihydropurin-6-imine
InChI:
InChI=1S/C7H11N5/c1-11-4-12(2)7-5(6(11)8)9-3-10-7/h3,8H,4H2,1-2H3,(H,9,10)
InChI Key:
AZPCPWOBXIAFIJ-UHFFFAOYSA-N
SMILES:
NC1=C2N=CN=C2N(CN1C)C
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.101g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
165.2g/mol
Monoisotopic Mass:
165.101g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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