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2002-36-0 | 9H-Purin-6-amine, 9-pentyl-
CAS No: 2002-36-0 Catalog No: AG002CM3 MDL No:
Product Description
Catalog Number:
AG002CM3
Chemical Name:
9H-Purin-6-amine, 9-pentyl-
CAS Number:
2002-36-0
Molecular Formula:
C10H15N5
Molecular Weight:
205.2596
IUPAC Name:
9-pentylpurin-6-amine
InChI:
InChI=1S/C10H15N5/c1-2-3-4-5-15-7-14-8-9(11)12-6-13-10(8)15/h6-7H,2-5H2,1H3,(H2,11,12,13)
InChI Key:
UHFFXCBWXZHMML-UHFFFAOYSA-N
SMILES:
CCCCCn1cnc2c1ncnc2N
NSC Number:
60637
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.133g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.265g/mol
Monoisotopic Mass:
205.133g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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