2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol

C16H16O2 — CID 67778845

IUPAC2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol
SMILESCC/C(=C\c1ccccc1O)c1ccccc1O
InChIInChI=1S/C16H16O2/c1-2-12(14-8-4-6-10-16(14)18)11-13-7-3-5-9-15(13)17/h3-11,17-18H,2H2,1H3/b12-11+
InChIKeyRXBRUBQYKHOVSE-VAWYXSNFSA-N
MW240.30 g/mol
LogP4.05
Rot. Bonds3

About 2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol

2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol (PubChem CID 67778845) has the molecular formula C16H16O2 and a molecular weight of 240.30 g/mol. Its IUPAC name is 2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol.

Molecular Properties

Compound Name2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol
PubChem CID67778845
Molecular FormulaC16H16O2
Molecular Weight240.30 g/mol
Exact Mass240.12
IUPAC Name2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol
SMILESCC/C(=C\c1ccccc1O)c1ccccc1O
InChIInChI=1S/C16H16O2/c1-2-12(14-8-4-6-10-16(14)18)11-13-7-3-5-9-15(13)17/h3-11,17-18H,2H2,1H3/b12-11+
InChIKeyRXBRUBQYKHOVSE-VAWYXSNFSA-N
XLogP4.05
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[(Z)-2-phenylbut-1-enyl]phenol
CID 11031503
2-hex-2-en-3-ylphenol
CID 57154775
2-(2,2-dibromoethenyl)phenol;ethane
CID 143581922
2,3,4-tris(2-phenylbut-1-enyl)phenol
CID 126505513
2-[(Z)-2-chloro-3-hydroxypent-1-enyl]phenol
CID 14869652
2-[(1Z,3Z)-hexa-1,3-dienyl]phenol
CID 89362238
(Z)-2-phenylbut-1-en-1-amine
CID 142213019
1-fluorobut-1-en-2-ylbenzene
CID 67823152
ethane;2-[(Z)-pent-1-enyl]phenol
CID 142052125
[(Z)-1-methylsulfanylbut-1-en-2-yl]benzene
CID 134933163
2-[(2-hydroxyphenyl)methylidene]propanedinitrile
CID 23409
3-(3-bromophenyl)-3-hydroxy-1-(2-hydroxyphenyl)prop-2-en-1-one
CID 7307866

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol?
The IUPAC name of 2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol (CID 67778845) is 2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol.
What is the SMILES notation for 2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol?
The canonical SMILES for 2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol is CC/C(=C\c1ccccc1O)c1ccccc1O.
What is the InChIKey of 2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol?
The InChIKey is RXBRUBQYKHOVSE-VAWYXSNFSA-N. The full InChI is InChI=1S/C16H16O2/c1-2-12(14-8-4-6-10-16(14)18)11-13-7-3-5-9-15(13)17/h3-11,17-18H,2H2,1H3/b12-11+.
What are the key properties of 2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol?
2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol has a molecular weight of 240.30 g/mol, XLogP of 4.05, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(2-hydroxyphenyl)but-1-enyl]phenol is sourced from PubChem (CID 67778845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).