2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol

C14H10Br2O2 — CID 45257938

IUPAC2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol
SMILESOc1ccc(/C=C/c2cc(Br)c(O)c(Br)c2)cc1
InChIInChI=1S/C14H10Br2O2/c15-12-7-10(8-13(16)14(12)18)2-1-9-3-5-11(17)6-4-9/h1-8,17-18H/b2-1+
InChIKeyKGDYRCIWRHRFPK-OWOJBTEDSA-N
MW370.04 g/mol
LogP4.79
Rot. Bonds2

About 2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol

2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol (PubChem CID 45257938) has the molecular formula C14H10Br2O2 and a molecular weight of 370.04 g/mol. Its IUPAC name is 2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol.

Molecular Properties

Compound Name2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol
PubChem CID45257938
Molecular FormulaC14H10Br2O2
Molecular Weight370.04 g/mol
Exact Mass367.90
IUPAC Name2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol
SMILESOc1ccc(/C=C/c2cc(Br)c(O)c(Br)c2)cc1
InChIInChI=1S/C14H10Br2O2/c15-12-7-10(8-13(16)14(12)18)2-1-9-3-5-11(17)6-4-9/h1-8,17-18H/b2-1+
InChIKeyKGDYRCIWRHRFPK-OWOJBTEDSA-N
XLogP4.79
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.04
LogP ≤ 54.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol?
The IUPAC name of 2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol (CID 45257938) is 2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol.
What is the SMILES notation for 2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol?
The canonical SMILES for 2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol is Oc1ccc(/C=C/c2cc(Br)c(O)c(Br)c2)cc1.
What is the InChIKey of 2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol?
The InChIKey is KGDYRCIWRHRFPK-OWOJBTEDSA-N. The full InChI is InChI=1S/C14H10Br2O2/c15-12-7-10(8-13(16)14(12)18)2-1-9-3-5-11(17)6-4-9/h1-8,17-18H/b2-1+.
What are the key properties of 2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol?
2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol has a molecular weight of 370.04 g/mol, XLogP of 4.79, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dibromo-4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenol is sourced from PubChem (CID 45257938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).