(2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol

C14H12BrFO2 — CID 114560429

IUPAC(2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol
SMILESCOc1ccc(C(O)c2c(F)cccc2Br)cc1
InChIInChI=1S/C14H12BrFO2/c1-18-10-7-5-9(6-8-10)14(17)13-11(15)3-2-4-12(13)16/h2-8,14,17H,1H3
InChIKeyFIJMSVJLBBRDOI-UHFFFAOYSA-N
MW311.15 g/mol
LogP3.68
Rot. Bonds3

About (2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol

(2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol (PubChem CID 114560429) has the molecular formula C14H12BrFO2 and a molecular weight of 311.15 g/mol. Its IUPAC name is (2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol.

Molecular Properties

Compound Name(2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol
PubChem CID114560429
Molecular FormulaC14H12BrFO2
Molecular Weight311.15 g/mol
Exact Mass310.00
IUPAC Name(2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol
SMILESCOc1ccc(C(O)c2c(F)cccc2Br)cc1
InChIInChI=1S/C14H12BrFO2/c1-18-10-7-5-9(6-8-10)14(17)13-11(15)3-2-4-12(13)16/h2-8,14,17H,1H3
InChIKeyFIJMSVJLBBRDOI-UHFFFAOYSA-N
XLogP3.68
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.15
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2-bromo-6-fluorophenyl)-naphthalen-2-ylmethanol
CID 114885765
N-[(2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methyl]ethanamine
CID 114558922
1-(2-bromo-6-fluorophenyl)-3-(4-methoxyphenyl)propan-1-ol
CID 114885667
(2-bromo-6-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 114560510
(3-bromo-4-fluorophenyl)-(2-fluoro-6-methoxyphenyl)methanol
CID 79746374
N-[(2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methyl]propan-1-amine
CID 114558955
(4-bromophenyl)-(2,6-difluorophenyl)methanol
CID 61100872
(2,6-difluorophenyl)-(3-methoxyphenyl)methanol
CID 63893352
(3-bromo-4-methoxyphenyl)-(2-chloro-6-fluorophenyl)methanol
CID 61100995
[(2,6-difluorophenyl)-(4-methoxyphenyl)methyl]hydrazine
CID 105190790
1-[2-(2-bromo-4-methoxyphenoxy)-6-fluorophenyl]ethanol
CID 104707954
(2-bromo-6-fluorophenyl)-thiophen-3-ylmethanol
CID 114885783

Frequently Asked Questions

What is the IUPAC name of (2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol?
The IUPAC name of (2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol (CID 114560429) is (2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol.
What is the SMILES notation for (2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol?
The canonical SMILES for (2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol is COc1ccc(C(O)c2c(F)cccc2Br)cc1.
What is the InChIKey of (2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol?
The InChIKey is FIJMSVJLBBRDOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrFO2/c1-18-10-7-5-9(6-8-10)14(17)13-11(15)3-2-4-12(13)16/h2-8,14,17H,1H3.
What are the key properties of (2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol?
(2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol has a molecular weight of 311.15 g/mol, XLogP of 3.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromo-6-fluorophenyl)-(4-methoxyphenyl)methanol is sourced from PubChem (CID 114560429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).