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2715-70-0 | 9-butyl-9H-purin-6-amine
CAS No: 2715-70-0 Catalog No: AG01FFPL MDL No:
Product Description
Catalog Number:
AG01FFPL
Chemical Name:
9-butyl-9H-purin-6-amine
CAS Number:
2715-70-0
IUPAC Name:
9-butylpurin-6-amine
InChI:
InChI=1S/C9H13N5/c1-2-3-4-14-6-13-7-8(10)11-5-12-9(7)14/h5-6H,2-4H2,1H3,(H2,10,11,12)
InChI Key:
BKXMJMZKKNIYRD-UHFFFAOYSA-N
NSC Number:
19094
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.117g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.238g/mol
Monoisotopic Mass:
191.117g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| 8-Bromo-9-alkyl adenine derivatives as tools for developing new adenosine A2A and A2B receptors ligands. | Bioorganic & medicinal chemistry 20090401 |
| A spectroscopic and photophysical study on molecular recognition via hydrogen-bonding and pi-pi stacking interactions. | Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20050101 |
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