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1000166-82-4 | 6H-Purin-6-one, 2-hydrazinyl-3,9-dihydro-3-pentyl-
CAS No: 1000166-82-4 Catalog No: AG0000A5 MDL No:
Product Description
Catalog Number:
AG0000A5
Chemical Name:
6H-Purin-6-one, 2-hydrazinyl-3,9-dihydro-3-pentyl-
CAS Number:
1000166-82-4
Molecular Formula:
C10H16N6O
Molecular Weight:
236.2736
IUPAC Name:
(2E)-2-hydrazinylidene-3-pentyl-5,7-dihydro-4H-purin-6-one
InChI:
InChI=1S/C10H18N6O/c1-2-3-4-5-16-8-7(12-6-13-8)9(17)14-10(16)15-11/h6-8H,2-5,11H2,1H3,(H,12,13)(H,14,15,17)
InChI Key:
IRONQDVFUWELJJ-UHFFFAOYSA-N
SMILES:
CCCCCn1c(NN)nc(=O)c2c1[nH]cn2
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
238.154g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
238.295g/mol
Monoisotopic Mass:
238.154g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
95.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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