[(1E)-5-phenylpenta-1,4-dienyl]benzene

C34H32 — CID 91021368

IUPAC[(1E)-5-phenylpenta-1,4-dienyl]benzene
SMILESC(=Cc1ccccc1)C/C=C/c1ccccc1.C(=Cc1ccccc1)C/C=C/c1ccccc1
InChIInChI=1S/2C17H16/c2*1-4-10-16(11-5-1)14-8-3-9-15-17-12-6-2-7-13-17/h2*1-2,4-15H,3H2/b2*14-8+,15-9?
InChIKeyFZWVHXUFKIGJPK-UOXAIQHFSA-N
MW440.63 g/mol
LogP9.61
Rot. Bonds8

About [(1E)-5-phenylpenta-1,4-dienyl]benzene

[(1E)-5-phenylpenta-1,4-dienyl]benzene (PubChem CID 91021368) has the molecular formula C34H32 and a molecular weight of 440.63 g/mol. Its IUPAC name is [(1E)-5-phenylpenta-1,4-dienyl]benzene.

Molecular Properties

Compound Name[(1E)-5-phenylpenta-1,4-dienyl]benzene
PubChem CID91021368
Molecular FormulaC34H32
Molecular Weight440.63 g/mol
Exact Mass440.25
IUPAC Name[(1E)-5-phenylpenta-1,4-dienyl]benzene
SMILESC(=Cc1ccccc1)C/C=C/c1ccccc1.C(=Cc1ccccc1)C/C=C/c1ccccc1
InChIInChI=1S/2C17H16/c2*1-4-10-16(11-5-1)14-8-3-9-15-17-12-6-2-7-13-17/h2*1-2,4-15H,3H2/b2*14-8+,15-9?
InChIKeyFZWVHXUFKIGJPK-UOXAIQHFSA-N
XLogP9.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.63
LogP ≤ 59.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

[(1E,4E)-hexa-1,4-dienyl]benzene
CID 13068859
[(1E,4Z,6Z)-nona-1,4,6-trienyl]benzene
CID 142095527
CID 140512150
CID 140512150
benzene;but-1-enylbenzene
CID 157481332
[(1E,4E,8E)-deca-1,4,8-trienyl]benzene
CID 5368425
[(E)-3-chloroprop-1-enyl]benzene;hydron
CID 174539817
[(E)-3-[[(E)-3-phenylprop-2-enyl]diselanyl]prop-1-enyl]benzene
CID 132528237
[(E)-3-[4-[(E)-3-phenylprop-2-enoxy]butoxy]prop-1-enyl]benzene
CID 15531171
trifluoro-[(E)-3-phenylprop-2-enyl]boranuide
CID 101487088
3-phenylprop-1-enylbenzene;tetrahydrofluoride
CID 174822249
CID 70567885
CID 70567885
CID 70569152
CID 70569152

Frequently Asked Questions

What is the IUPAC name of [(1E)-5-phenylpenta-1,4-dienyl]benzene?
The IUPAC name of [(1E)-5-phenylpenta-1,4-dienyl]benzene (CID 91021368) is [(1E)-5-phenylpenta-1,4-dienyl]benzene.
What is the SMILES notation for [(1E)-5-phenylpenta-1,4-dienyl]benzene?
The canonical SMILES for [(1E)-5-phenylpenta-1,4-dienyl]benzene is C(=Cc1ccccc1)C/C=C/c1ccccc1.C(=Cc1ccccc1)C/C=C/c1ccccc1.
What is the InChIKey of [(1E)-5-phenylpenta-1,4-dienyl]benzene?
The InChIKey is FZWVHXUFKIGJPK-UOXAIQHFSA-N. The full InChI is InChI=1S/2C17H16/c2*1-4-10-16(11-5-1)14-8-3-9-15-17-12-6-2-7-13-17/h2*1-2,4-15H,3H2/b2*14-8+,15-9?.
What are the key properties of [(1E)-5-phenylpenta-1,4-dienyl]benzene?
[(1E)-5-phenylpenta-1,4-dienyl]benzene has a molecular weight of 440.63 g/mol, XLogP of 9.61, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(1E)-5-phenylpenta-1,4-dienyl]benzene is sourced from PubChem (CID 91021368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).