2-[(E)-4-phenylbut-1-enyl]furan

C14H14O — CID 169432346

IUPAC2-[(E)-4-phenylbut-1-enyl]furan
SMILESC(=C/c1ccco1)\CCc1ccccc1
InChIInChI=1S/C14H14O/c1-2-7-13(8-3-1)9-4-5-10-14-11-6-12-15-14/h1-3,5-8,10-12H,4,9H2/b10-5+
InChIKeyQAJLAEZVUQXIPM-BJMVGYQFSA-N
MW198.26 g/mol
LogP3.93
Rot. Bonds4

About 2-[(E)-4-phenylbut-1-enyl]furan

2-[(E)-4-phenylbut-1-enyl]furan (PubChem CID 169432346) has the molecular formula C14H14O and a molecular weight of 198.26 g/mol. Its IUPAC name is 2-[(E)-4-phenylbut-1-enyl]furan.

Molecular Properties

Compound Name2-[(E)-4-phenylbut-1-enyl]furan
PubChem CID169432346
Molecular FormulaC14H14O
Molecular Weight198.26 g/mol
Exact Mass198.10
IUPAC Name2-[(E)-4-phenylbut-1-enyl]furan
SMILESC(=C/c1ccco1)\CCc1ccccc1
InChIInChI=1S/C14H14O/c1-2-7-13(8-3-1)9-4-5-10-14-11-6-12-15-14/h1-3,5-8,10-12H,4,9H2/b10-5+
InChIKeyQAJLAEZVUQXIPM-BJMVGYQFSA-N
XLogP3.93
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.26
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-4-phenylbut-1-enyl]furan?
The IUPAC name of 2-[(E)-4-phenylbut-1-enyl]furan (CID 169432346) is 2-[(E)-4-phenylbut-1-enyl]furan.
What is the SMILES notation for 2-[(E)-4-phenylbut-1-enyl]furan?
The canonical SMILES for 2-[(E)-4-phenylbut-1-enyl]furan is C(=C/c1ccco1)\CCc1ccccc1.
What is the InChIKey of 2-[(E)-4-phenylbut-1-enyl]furan?
The InChIKey is QAJLAEZVUQXIPM-BJMVGYQFSA-N. The full InChI is InChI=1S/C14H14O/c1-2-7-13(8-3-1)9-4-5-10-14-11-6-12-15-14/h1-3,5-8,10-12H,4,9H2/b10-5+.
What are the key properties of 2-[(E)-4-phenylbut-1-enyl]furan?
2-[(E)-4-phenylbut-1-enyl]furan has a molecular weight of 198.26 g/mol, XLogP of 3.93, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-4-phenylbut-1-enyl]furan is sourced from PubChem (CID 169432346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).