[(E)-1-phenylhex-1-en-2-yl]benzene

C18H20 — CID 11791205

IUPAC[(E)-1-phenylhex-1-en-2-yl]benzene
SMILESCCCC/C(=C\c1ccccc1)c1ccccc1
InChIInChI=1S/C18H20/c1-2-3-12-18(17-13-8-5-9-14-17)15-16-10-6-4-7-11-16/h4-11,13-15H,2-3,12H2,1H3/b18-15+
InChIKeyUKPODFRZGIFARJ-OBGWFSINSA-N
MW236.36 g/mol
LogP5.42
Rot. Bonds5

About [(E)-1-phenylhex-1-en-2-yl]benzene

[(E)-1-phenylhex-1-en-2-yl]benzene (PubChem CID 11791205) has the molecular formula C18H20 and a molecular weight of 236.36 g/mol. Its IUPAC name is [(E)-1-phenylhex-1-en-2-yl]benzene.

Molecular Properties

Compound Name[(E)-1-phenylhex-1-en-2-yl]benzene
PubChem CID11791205
Molecular FormulaC18H20
Molecular Weight236.36 g/mol
Exact Mass236.16
IUPAC Name[(E)-1-phenylhex-1-en-2-yl]benzene
SMILESCCCC/C(=C\c1ccccc1)c1ccccc1
InChIInChI=1S/C18H20/c1-2-3-12-18(17-13-8-5-9-14-17)15-16-10-6-4-7-11-16/h4-11,13-15H,2-3,12H2,1H3/b18-15+
InChIKeyUKPODFRZGIFARJ-OBGWFSINSA-N
XLogP5.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500236.36
LogP ≤ 55.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-fluoro-4-[(E)-1-phenylhex-1-en-2-yl]benzene
CID 72736917
1-fluoro-4-[(E)-1-phenyloct-1-en-2-yl]benzene
CID 44521359
[(E)-hept-2-en-3-yl]benzene
CID 14568345
ethyl 4-[(Z)-1-phenylhept-1-en-2-yl]benzoate
CID 23658634
[(Z)-non-3-en-4-yl]benzene
CID 101008148
2-(1,2-diphenylethenyl)hex-1-enyl-trimethylsilane
CID 10437633
(2E)-2-benzylidenehexanoic acid
CID 5354388
[(1Z)-5-methyl-1-phenylhexa-1,5-dien-2-yl]benzene
CID 177384846
1-bromo-4-[(1Z,6Z)-7-(4-bromophenyl)-2,6-diphenylhepta-1,6-dienyl]benzene
CID 101013816
1-chloro-2-[(Z)-1-phenyloct-1-en-2-yl]benzene
CID 101104759
N-[4-[butyl(6,7-diphenylhept-6-enyl)phosphanyl]butyl]-N-phenylaniline;hydrobromide
CID 173248698
[6-phenyl-4-[(Z)-2-phenylhex-1-enyl]pyran-2-ylidene]tungsten
CID 11193006

Frequently Asked Questions

What is the IUPAC name of [(E)-1-phenylhex-1-en-2-yl]benzene?
The IUPAC name of [(E)-1-phenylhex-1-en-2-yl]benzene (CID 11791205) is [(E)-1-phenylhex-1-en-2-yl]benzene.
What is the SMILES notation for [(E)-1-phenylhex-1-en-2-yl]benzene?
The canonical SMILES for [(E)-1-phenylhex-1-en-2-yl]benzene is CCCC/C(=C\c1ccccc1)c1ccccc1.
What is the InChIKey of [(E)-1-phenylhex-1-en-2-yl]benzene?
The InChIKey is UKPODFRZGIFARJ-OBGWFSINSA-N. The full InChI is InChI=1S/C18H20/c1-2-3-12-18(17-13-8-5-9-14-17)15-16-10-6-4-7-11-16/h4-11,13-15H,2-3,12H2,1H3/b18-15+.
What are the key properties of [(E)-1-phenylhex-1-en-2-yl]benzene?
[(E)-1-phenylhex-1-en-2-yl]benzene has a molecular weight of 236.36 g/mol, XLogP of 5.42, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-1-phenylhex-1-en-2-yl]benzene is sourced from PubChem (CID 11791205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).