4-[2-(3-bromophenyl)ethenyl]phenol

C14H11BrO — CID 68626612

IUPAC4-[2-(3-bromophenyl)ethenyl]phenol
SMILESOc1ccc(C=Cc2cccc(Br)c2)cc1
InChIInChI=1S/C14H11BrO/c15-13-3-1-2-12(10-13)5-4-11-6-8-14(16)9-7-11/h1-10,16H
InChIKeyHPOFDLLFBZKCDP-UHFFFAOYSA-N
MW275.15 g/mol
LogP4.33
Rot. Bonds2

About 4-[2-(3-bromophenyl)ethenyl]phenol

4-[2-(3-bromophenyl)ethenyl]phenol (PubChem CID 68626612) has the molecular formula C14H11BrO and a molecular weight of 275.15 g/mol. Its IUPAC name is 4-[2-(3-bromophenyl)ethenyl]phenol.

Molecular Properties

Compound Name4-[2-(3-bromophenyl)ethenyl]phenol
PubChem CID68626612
Molecular FormulaC14H11BrO
Molecular Weight275.15 g/mol
Exact Mass274.00
IUPAC Name4-[2-(3-bromophenyl)ethenyl]phenol
SMILESOc1ccc(C=Cc2cccc(Br)c2)cc1
InChIInChI=1S/C14H11BrO/c15-13-3-1-2-12(10-13)5-4-11-6-8-14(16)9-7-11/h1-10,16H
InChIKeyHPOFDLLFBZKCDP-UHFFFAOYSA-N
XLogP4.33
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.15
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-bromo-3-[(Z)-2-(4-bromophenyl)ethenyl]benzene
CID 67720671
1-bromo-3-[(Z)-2-(3-bromophenyl)ethenyl]benzene
CID 15605739
1-bromo-3-[(E)-2-phenylethenyl]benzene
CID 5374624
3-[(E)-2-(4-hydroxyphenyl)ethenyl]benzaldehyde
CID 59310574
4-[(Z)-2-(3-bromophenyl)ethenyl]pyridine
CID 10038211
4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]phenol
CID 52942315
4-(2-phenylethenyl)phenol
CID 157400568
1-bromo-2-[(E)-2-(3-bromophenyl)ethenyl]benzene
CID 10315048
4-[(E)-2-(3-phenoxyphenyl)ethenyl]phenol
CID 11587340
4-[(3-bromophenyl)iminomethyl]phenol
CID 868394
4-[2-(4-hydroxyphenyl)ethenyl]benzene-1,2-diol
CID 54294164
3-[(E)-2-(3-bromophenyl)ethenyl]pyridine
CID 69086206

Frequently Asked Questions

What is the IUPAC name of 4-[2-(3-bromophenyl)ethenyl]phenol?
The IUPAC name of 4-[2-(3-bromophenyl)ethenyl]phenol (CID 68626612) is 4-[2-(3-bromophenyl)ethenyl]phenol.
What is the SMILES notation for 4-[2-(3-bromophenyl)ethenyl]phenol?
The canonical SMILES for 4-[2-(3-bromophenyl)ethenyl]phenol is Oc1ccc(C=Cc2cccc(Br)c2)cc1.
What is the InChIKey of 4-[2-(3-bromophenyl)ethenyl]phenol?
The InChIKey is HPOFDLLFBZKCDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrO/c15-13-3-1-2-12(10-13)5-4-11-6-8-14(16)9-7-11/h1-10,16H.
What are the key properties of 4-[2-(3-bromophenyl)ethenyl]phenol?
4-[2-(3-bromophenyl)ethenyl]phenol has a molecular weight of 275.15 g/mol, XLogP of 4.33, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(3-bromophenyl)ethenyl]phenol is sourced from PubChem (CID 68626612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).