1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene

C12H8 — CID 177409743

IUPAC1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene
SMILESC=C(C1=C=CC=C1)C1=C=CC=C1
InChIInChI=1S/C12H8/c1-10(11-6-2-3-7-11)12-8-4-5-9-12/h2-6,8H,1H2
InChIKeyFOUQAQLKVYZRFC-UHFFFAOYSA-N
MW152.20 g/mol
LogP2.85
Rot. Bonds2

About 1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene

1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene (PubChem CID 177409743) has the molecular formula C12H8 and a molecular weight of 152.20 g/mol. Its IUPAC name is 1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene.

Molecular Properties

Compound Name1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene
PubChem CID177409743
Molecular FormulaC12H8
Molecular Weight152.20 g/mol
Exact Mass152.06
IUPAC Name1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene
SMILESC=C(C1=C=CC=C1)C1=C=CC=C1
InChIInChI=1S/C12H8/c1-10(11-6-2-3-7-11)12-8-4-5-9-12/h2-6,8H,1H2
InChIKeyFOUQAQLKVYZRFC-UHFFFAOYSA-N
XLogP2.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene?
The IUPAC name of 1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene (CID 177409743) is 1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene.
What is the SMILES notation for 1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene?
The canonical SMILES for 1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene is C=C(C1=C=CC=C1)C1=C=CC=C1.
What is the InChIKey of 1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene?
The InChIKey is FOUQAQLKVYZRFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8/c1-10(11-6-2-3-7-11)12-8-4-5-9-12/h2-6,8H,1H2.
What are the key properties of 1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene?
1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene has a molecular weight of 152.20 g/mol, XLogP of 2.85, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopenta-1,2,4-trien-1-ylethenyl)cyclopenta-1,2,4-triene is sourced from PubChem (CID 177409743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).