(3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol

C15H14BrFO2 — CID 106644458

IUPAC(3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol
SMILESCOCc1ccc(C(O)c2cccc(Br)c2F)cc1
InChIInChI=1S/C15H14BrFO2/c1-19-9-10-5-7-11(8-6-10)15(18)12-3-2-4-13(16)14(12)17/h2-8,15,18H,9H2,1H3
InChIKeyYMZOJYPXJIVEEE-UHFFFAOYSA-N
MW325.18 g/mol
LogP3.82
Rot. Bonds4

About (3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol

(3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol (PubChem CID 106644458) has the molecular formula C15H14BrFO2 and a molecular weight of 325.18 g/mol. Its IUPAC name is (3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol.

Molecular Properties

Compound Name(3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol
PubChem CID106644458
Molecular FormulaC15H14BrFO2
Molecular Weight325.18 g/mol
Exact Mass324.02
IUPAC Name(3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol
SMILESCOCc1ccc(C(O)c2cccc(Br)c2F)cc1
InChIInChI=1S/C15H14BrFO2/c1-19-9-10-5-7-11(8-6-10)15(18)12-3-2-4-13(16)14(12)17/h2-8,15,18H,9H2,1H3
InChIKeyYMZOJYPXJIVEEE-UHFFFAOYSA-N
XLogP3.82
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 ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-bromo-2-fluorophenyl)-(4-fluoro-3,5-dimethylphenyl)methanol
CID 107955673
(3-bromo-2-fluorophenyl)-(3,5-difluorophenyl)methanol
CID 106644628
(3-bromo-2-fluorophenyl)-(2-fluoro-3-methylphenyl)methanol
CID 106648481
1-(3-bromo-2-fluorophenyl)-2-(3,4-dimethoxyphenyl)ethanol
CID 106645022
(3-bromo-2-fluorophenyl)-(4-fluoro-2-methoxyphenyl)methanol
CID 86730397
(3-bromo-4-methoxyphenyl)-(2,3-difluorophenyl)methanol
CID 62660225
(3-bromo-2-fluorophenyl)-(2,6-dimethylphenyl)methanol
CID 106644550
(3-bromo-2-fluorophenyl)-(2-bromo-5-methoxyphenyl)methanol
CID 106648491
(4-bromo-3-methylphenyl)-(2-fluoro-3-methoxyphenyl)methanol
CID 82806466
3,4-dihydro-2H-chromen-8-yl-[4-(methoxymethyl)phenyl]methanol
CID 114743509
methyl 2-(3-bromo-2-fluorophenyl)-2-hydroxyacetate
CID 106644466
(3-bromo-2-fluorophenyl)-(3-methoxypyrazin-2-yl)methanol
CID 114020210

Frequently Asked Questions

What is the IUPAC name of (3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol?
The IUPAC name of (3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol (CID 106644458) is (3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol.
What is the SMILES notation for (3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol?
The canonical SMILES for (3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol is COCc1ccc(C(O)c2cccc(Br)c2F)cc1.
What is the InChIKey of (3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol?
The InChIKey is YMZOJYPXJIVEEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrFO2/c1-19-9-10-5-7-11(8-6-10)15(18)12-3-2-4-13(16)14(12)17/h2-8,15,18H,9H2,1H3.
What are the key properties of (3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol?
(3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol has a molecular weight of 325.18 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromo-2-fluorophenyl)-[4-(methoxymethyl)phenyl]methanol is sourced from PubChem (CID 106644458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).