[2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol

C15H14BrFO2 — CID 79706071

IUPAC[2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol
SMILESCc1ccc(OCc2cc(F)cc(Br)c2)c(CO)c1
InChIInChI=1S/C15H14BrFO2/c1-10-2-3-15(12(4-10)8-18)19-9-11-5-13(16)7-14(17)6-11/h2-7,18H,8-9H2,1H3
InChIKeyREYKABOIGOLHHO-UHFFFAOYSA-N
MW325.18 g/mol
LogP3.97
Rot. Bonds4

About [2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol

[2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol (PubChem CID 79706071) has the molecular formula C15H14BrFO2 and a molecular weight of 325.18 g/mol. Its IUPAC name is [2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol.

Molecular Properties

Compound Name[2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol
PubChem CID79706071
Molecular FormulaC15H14BrFO2
Molecular Weight325.18 g/mol
Exact Mass324.02
IUPAC Name[2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol
SMILESCc1ccc(OCc2cc(F)cc(Br)c2)c(CO)c1
InChIInChI=1S/C15H14BrFO2/c1-10-2-3-15(12(4-10)8-18)19-9-11-5-13(16)7-14(17)6-11/h2-7,18H,8-9H2,1H3
InChIKeyREYKABOIGOLHHO-UHFFFAOYSA-N
XLogP3.97
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.18
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]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

[5-bromo-2-[(3-bromo-5-fluorophenyl)methoxy]phenyl]methanol
CID 79705698
2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylbenzaldehyde
CID 79705645
[5-fluoro-2-[(4-methylphenyl)methoxy]phenyl]methanol
CID 107698416
[4-[(3-bromo-5-fluorophenyl)methoxy]-3-ethoxyphenyl]methanol
CID 79698175
[2-[(2,5-dimethylphenyl)methoxy]-5-fluorophenyl]methanol
CID 107698577
[3-bromo-2-[(3-bromo-5-fluorophenyl)methoxy]phenyl]methanol
CID 79706812
[2-[(2-chloro-5-fluorophenyl)methoxy]-5-methylphenyl]methanol
CID 102616489
5-bromo-2-[(3-bromo-5-fluorophenyl)methoxy]benzenecarbothioamide
CID 83145817
2-(bromomethyl)-1-[(4-fluorophenyl)methoxy]-4-methylbenzene
CID 63535072
3-[(3-bromo-5-fluorophenyl)methoxy]-4-methylaniline
CID 79704583
1-[2-[(3-bromo-5-fluorophenyl)methoxy]phenyl]propan-2-amine
CID 79709715
4-[(3-bromo-5-fluorophenyl)methoxy]-3-prop-2-enylaniline
CID 79705061

Frequently Asked Questions

What is the IUPAC name of [2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol?
The IUPAC name of [2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol (CID 79706071) is [2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol.
What is the SMILES notation for [2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol?
The canonical SMILES for [2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol is Cc1ccc(OCc2cc(F)cc(Br)c2)c(CO)c1.
What is the InChIKey of [2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol?
The InChIKey is REYKABOIGOLHHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrFO2/c1-10-2-3-15(12(4-10)8-18)19-9-11-5-13(16)7-14(17)6-11/h2-7,18H,8-9H2,1H3.
What are the key properties of [2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol?
[2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol has a molecular weight of 325.18 g/mol, XLogP of 3.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(3-bromo-5-fluorophenyl)methoxy]-5-methylphenyl]methanol is sourced from PubChem (CID 79706071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).