tricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene

C15H12 — CID 154429334

IUPACtricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene
SMILESC1=CC=C2C=CC=CC3=CC=CC23C=C1
InChIInChI=1S/C15H12/c1-2-7-13-8-3-4-9-14-10-6-12-15(13,14)11-5-1/h1-12H
InChIKeyZEKXUMIQFLXGKJ-UHFFFAOYSA-N
MW192.26 g/mol
LogP3.65
Rot. Bonds

About tricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene

tricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene (PubChem CID 154429334) has the molecular formula C15H12 and a molecular weight of 192.26 g/mol. Its IUPAC name is tricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene.

Molecular Properties

Compound Nametricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene
PubChem CID154429334
Molecular FormulaC15H12
Molecular Weight192.26 g/mol
Exact Mass192.09
IUPAC Nametricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene
SMILESC1=CC=C2C=CC=CC3=CC=CC23C=C1
InChIInChI=1S/C15H12/c1-2-7-13-8-3-4-9-14-10-6-12-15(13,14)11-5-1/h1-12H
InChIKeyZEKXUMIQFLXGKJ-UHFFFAOYSA-N
XLogP3.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of tricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene?
The IUPAC name of tricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene (CID 154429334) is tricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene.
What is the SMILES notation for tricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene?
The canonical SMILES for tricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene is C1=CC=C2C=CC=CC3=CC=CC23C=C1.
What is the InChIKey of tricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene?
The InChIKey is ZEKXUMIQFLXGKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12/c1-2-7-13-8-3-4-9-14-10-6-12-15(13,14)11-5-1/h1-12H.
What are the key properties of tricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene?
tricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene has a molecular weight of 192.26 g/mol, XLogP of 3.65, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tricyclo[8.5.0.01,5]pentadeca-2,4,6,8,10,12,14-heptaene is sourced from PubChem (CID 154429334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).