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Home > Other Heterocycles > 78668-34-5
78668-34-5 | 3,6,9,15-Tetraazabicyclo[9.3.1]pentadeca-1(15),11,13-triene
CAS No: 78668-34-5 Catalog No: AG0058RR MDL No:
Product Description
Catalog Number:
AG0058RR
Chemical Name:
3,6,9,15-Tetraazabicyclo[9.3.1]pentadeca-1(15),11,13-triene
CAS Number:
78668-34-5
Molecular Formula:
C11H18N4
Molecular Weight:
206.2874
IUPAC Name:
3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(15),11,13-triene
InChI:
InChI=1S/C11H18N4/c1-2-10-8-13-6-4-12-5-7-14-9-11(3-1)15-10/h1-3,12-14H,4-9H2
InChI Key:
LNMUPMQUMCDOKO-UHFFFAOYSA-N
SMILES:
C1CNCc2cccc(n2)CNCCN1
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.153g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
206.293g/mol
Monoisotopic Mass:
206.153g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1
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