2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan

C18H14O2 — CID 91360504

IUPAC2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan
SMILESC(=Cc1ccccc1C=Cc1ccco1)c1ccco1
InChIInChI=1S/C18H14O2/c1-2-6-16(10-12-18-8-4-14-20-18)15(5-1)9-11-17-7-3-13-19-17/h1-14H
InChIKeyIBAHDFQUBASTMF-UHFFFAOYSA-N
MW262.31 g/mol
LogP5.21
Rot. Bonds4

About 2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan

2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan (PubChem CID 91360504) has the molecular formula C18H14O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is 2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan.

Molecular Properties

Compound Name2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan
PubChem CID91360504
Molecular FormulaC18H14O2
Molecular Weight262.31 g/mol
Exact Mass262.10
IUPAC Name2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan
SMILESC(=Cc1ccccc1C=Cc1ccco1)c1ccco1
InChIInChI=1S/C18H14O2/c1-2-6-16(10-12-18-8-4-14-20-18)15(5-1)9-11-17-7-3-13-19-17/h1-14H
InChIKeyIBAHDFQUBASTMF-UHFFFAOYSA-N
XLogP5.21
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.31
LogP ≤ 55.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan?
The IUPAC name of 2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan (CID 91360504) is 2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan.
What is the SMILES notation for 2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan?
The canonical SMILES for 2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan is C(=Cc1ccccc1C=Cc1ccco1)c1ccco1.
What is the InChIKey of 2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan?
The InChIKey is IBAHDFQUBASTMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14O2/c1-2-6-16(10-12-18-8-4-14-20-18)15(5-1)9-11-17-7-3-13-19-17/h1-14H.
What are the key properties of 2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan?
2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan has a molecular weight of 262.31 g/mol, XLogP of 5.21, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan is sourced from PubChem (CID 91360504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).