icosa-1,3,5,7,9,11,13,15,17-nonaene

C20H24 — CID 91364807

IUPACicosa-1,3,5,7,9,11,13,15,17-nonaene
SMILESC=CC=CC=CC=CC=CC=CC=CC=CC=CCC
InChIInChI=1S/C20H24/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3,5-20H,1,4H2,2H3
InChIKeyMAAPVBNZGHHADP-UHFFFAOYSA-N
MW264.41 g/mol
LogP6.03
Rot. Bonds9

About icosa-1,3,5,7,9,11,13,15,17-nonaene

icosa-1,3,5,7,9,11,13,15,17-nonaene (PubChem CID 91364807) has the molecular formula C20H24 and a molecular weight of 264.41 g/mol. Its IUPAC name is icosa-1,3,5,7,9,11,13,15,17-nonaene.

Molecular Properties

Compound Nameicosa-1,3,5,7,9,11,13,15,17-nonaene
PubChem CID91364807
Molecular FormulaC20H24
Molecular Weight264.41 g/mol
Exact Mass264.19
IUPAC Nameicosa-1,3,5,7,9,11,13,15,17-nonaene
SMILESC=CC=CC=CC=CC=CC=CC=CC=CC=CCC
InChIInChI=1S/C20H24/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3,5-20H,1,4H2,2H3
InChIKeyMAAPVBNZGHHADP-UHFFFAOYSA-N
XLogP6.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500264.41
LogP ≤ 56.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of icosa-1,3,5,7,9,11,13,15,17-nonaene?
The IUPAC name of icosa-1,3,5,7,9,11,13,15,17-nonaene (CID 91364807) is icosa-1,3,5,7,9,11,13,15,17-nonaene.
What is the SMILES notation for icosa-1,3,5,7,9,11,13,15,17-nonaene?
The canonical SMILES for icosa-1,3,5,7,9,11,13,15,17-nonaene is C=CC=CC=CC=CC=CC=CC=CC=CC=CCC.
What is the InChIKey of icosa-1,3,5,7,9,11,13,15,17-nonaene?
The InChIKey is MAAPVBNZGHHADP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3,5-20H,1,4H2,2H3.
What are the key properties of icosa-1,3,5,7,9,11,13,15,17-nonaene?
icosa-1,3,5,7,9,11,13,15,17-nonaene has a molecular weight of 264.41 g/mol, XLogP of 6.03, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for icosa-1,3,5,7,9,11,13,15,17-nonaene is sourced from PubChem (CID 91364807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).