2-[4-[(E)-2-phenylethenyl]phenyl]ethanol

C16H16O — CID 155547178

IUPAC2-[4-[(E)-2-phenylethenyl]phenyl]ethanol
SMILESOCCc1ccc(/C=C/c2ccccc2)cc1
InChIInChI=1S/C16H16O/c17-13-12-16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h1-11,17H,12-13H2/b7-6+
InChIKeyLITDLHKMDPUHNV-VOTSOKGWSA-N
MW224.30 g/mol
LogP3.39
Rot. Bonds4

About 2-[4-[(E)-2-phenylethenyl]phenyl]ethanol

2-[4-[(E)-2-phenylethenyl]phenyl]ethanol (PubChem CID 155547178) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is 2-[4-[(E)-2-phenylethenyl]phenyl]ethanol.

Molecular Properties

Compound Name2-[4-[(E)-2-phenylethenyl]phenyl]ethanol
PubChem CID155547178
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name2-[4-[(E)-2-phenylethenyl]phenyl]ethanol
SMILESOCCc1ccc(/C=C/c2ccccc2)cc1
InChIInChI=1S/C16H16O/c17-13-12-16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h1-11,17H,12-13H2/b7-6+
InChIKeyLITDLHKMDPUHNV-VOTSOKGWSA-N
XLogP3.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[(E)-2-phenylethenyl]phenyl]ethanol?
The IUPAC name of 2-[4-[(E)-2-phenylethenyl]phenyl]ethanol (CID 155547178) is 2-[4-[(E)-2-phenylethenyl]phenyl]ethanol.
What is the SMILES notation for 2-[4-[(E)-2-phenylethenyl]phenyl]ethanol?
The canonical SMILES for 2-[4-[(E)-2-phenylethenyl]phenyl]ethanol is OCCc1ccc(/C=C/c2ccccc2)cc1.
What is the InChIKey of 2-[4-[(E)-2-phenylethenyl]phenyl]ethanol?
The InChIKey is LITDLHKMDPUHNV-VOTSOKGWSA-N. The full InChI is InChI=1S/C16H16O/c17-13-12-16-10-8-15(9-11-16)7-6-14-4-2-1-3-5-14/h1-11,17H,12-13H2/b7-6+.
What are the key properties of 2-[4-[(E)-2-phenylethenyl]phenyl]ethanol?
2-[4-[(E)-2-phenylethenyl]phenyl]ethanol has a molecular weight of 224.30 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(E)-2-phenylethenyl]phenyl]ethanol is sourced from PubChem (CID 155547178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).