[1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene

C30H20 — CID 101344765

IUPAC[1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene
SMILESC(=C=C=C=C(c1ccccc1)C1C=CC=C1)=C=C=C(c1ccccc1)C1C=CC=C1
InChIInChI=1S/C30H20/c1(9-23-29(27-19-11-12-20-27)25-15-5-3-6-16-25)2-10-24-30(28-21-13-14-22-28)26-17-7-4-8-18-26/h3-8,11-22,27-28H
InChIKeyIDYZMIBIKJOCJV-UHFFFAOYSA-N
MW380.49 g/mol
LogP7.01
Rot. Bonds4

About [1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene

[1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene (PubChem CID 101344765) has the molecular formula C30H20 and a molecular weight of 380.49 g/mol. Its IUPAC name is [1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene.

Molecular Properties

Compound Name[1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene
PubChem CID101344765
Molecular FormulaC30H20
Molecular Weight380.49 g/mol
Exact Mass380.16
IUPAC Name[1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene
SMILESC(=C=C=C=C(c1ccccc1)C1C=CC=C1)=C=C=C(c1ccccc1)C1C=CC=C1
InChIInChI=1S/C30H20/c1(9-23-29(27-19-11-12-20-27)25-15-5-3-6-16-25)2-10-24-30(28-21-13-14-22-28)26-17-7-4-8-18-26/h3-8,11-22,27-28H
InChIKeyIDYZMIBIKJOCJV-UHFFFAOYSA-N
XLogP7.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.49
LogP ≤ 57.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(NE)-N-[cyclopenta-2,4-dien-1-yl(phenyl)methylidene]hydroxylamine
CID 11987098
2-cyclopenta-2,4-dien-1-yl-1-phenylprop-2-en-1-one
CID 136630217
benzoic acid;(1R,2S)-cyclohexa-3,5-diene-1,2-diol
CID 71406115
1-cyclopenta-2,4-dien-1-yl-N-(4-methylphenyl)-1-phenylmethanimine
CID 15182209
1-chloro-4-[6-(4-chlorophenyl)-1,6-diphenylhexa-1,2,3,4,5-pentaenyl]benzene
CID 134977772
1,2-diphenylethane-1,2-dione;iron
CID 70488368
(E)-1,2-diphenylethene-1,2-dithiolate
CID 102075609
4-[(E)-1,2-di(cyclopenta-2,4-dien-1-yl)-2-(2,6-diphenylpyrylium-4-yl)ethenyl]-2,6-diphenylpyrylium
CID 102031841
(1,6-dichlorocyclohexa-2,4-dien-1-yl)-phenylmethanone
CID 174997196
(E)-3-(2-chlorophenyl)-1-cyclopenta-2,4-dien-1-ylprop-2-en-1-one
CID 12072432
(Z)-1,2-diphenylethene-1,2-diol
CID 11012436
CID 12505640
CID 12505640

Frequently Asked Questions

What is the IUPAC name of [1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene?
The IUPAC name of [1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene (CID 101344765) is [1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene.
What is the SMILES notation for [1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene?
The canonical SMILES for [1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene is C(=C=C=C=C(c1ccccc1)C1C=CC=C1)=C=C=C(c1ccccc1)C1C=CC=C1.
What is the InChIKey of [1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene?
The InChIKey is IDYZMIBIKJOCJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H20/c1(9-23-29(27-19-11-12-20-27)25-15-5-3-6-16-25)2-10-24-30(28-21-13-14-22-28)26-17-7-4-8-18-26/h3-8,11-22,27-28H.
What are the key properties of [1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene?
[1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene has a molecular weight of 380.49 g/mol, XLogP of 7.01, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [1,8-di(cyclopenta-2,4-dien-1-yl)-8-phenylocta-1,2,3,4,5,6,7-heptaenyl]benzene is sourced from PubChem (CID 101344765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).