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148019-91-4 | 1H-Purine-6,8-diamine, N8,N8,1-trimethyl-
CAS No: 148019-91-4 Catalog No: AG001FD7 MDL No:
Product Description
Catalog Number:
AG001FD7
Chemical Name:
1H-Purine-6,8-diamine, N8,N8,1-trimethyl-
CAS Number:
148019-91-4
Molecular Formula:
C8H12N6
Molecular Weight:
192.2211
IUPAC Name:
6-imino-N,N,1-trimethyl-7H-purin-8-amine
InChI:
InChI=1S/C8H12N6/c1-13(2)8-11-5-6(9)14(3)4-10-7(5)12-8/h4,9H,1-3H3,(H,11,12)
InChI Key:
CZOWWGQVHVDQOF-UHFFFAOYSA-N
SMILES:
CN(c1nc2c(n1)c(N)n(cn2)C)C
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.112g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
192.226g/mol
Monoisotopic Mass:
192.112g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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