[5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol

C15H12BrFO — CID 58623323

IUPAC[5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol
SMILESC=C(c1ccc(F)cc1)c1ccc(Br)cc1CO
InChIInChI=1S/C15H12BrFO/c1-10(11-2-5-14(17)6-3-11)15-7-4-13(16)8-12(15)9-18/h2-8,18H,1,9H2
InChIKeyFPMMIPHFECUVNJ-UHFFFAOYSA-N
MW307.16 g/mol
LogP4.14
Rot. Bonds3

About [5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol

[5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol (PubChem CID 58623323) has the molecular formula C15H12BrFO and a molecular weight of 307.16 g/mol. Its IUPAC name is [5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol.

Molecular Properties

Compound Name[5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol
PubChem CID58623323
Molecular FormulaC15H12BrFO
Molecular Weight307.16 g/mol
Exact Mass306.01
IUPAC Name[5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol
SMILESC=C(c1ccc(F)cc1)c1ccc(Br)cc1CO
InChIInChI=1S/C15H12BrFO/c1-10(11-2-5-14(17)6-3-11)15-7-4-13(16)8-12(15)9-18/h2-8,18H,1,9H2
InChIKeyFPMMIPHFECUVNJ-UHFFFAOYSA-N
XLogP4.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.16
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol?
The IUPAC name of [5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol (CID 58623323) is [5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol.
What is the SMILES notation for [5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol?
The canonical SMILES for [5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol is C=C(c1ccc(F)cc1)c1ccc(Br)cc1CO.
What is the InChIKey of [5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol?
The InChIKey is FPMMIPHFECUVNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrFO/c1-10(11-2-5-14(17)6-3-11)15-7-4-13(16)8-12(15)9-18/h2-8,18H,1,9H2.
What are the key properties of [5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol?
[5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol has a molecular weight of 307.16 g/mol, XLogP of 4.14, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [5-bromo-2-[1-(4-fluorophenyl)ethenyl]phenyl]methanol is sourced from PubChem (CID 58623323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).