(4-bromo-2-fluorophenyl)methanol

C7H6BrFO — CID 2734027

IUPAC(4-bromo-2-fluorophenyl)methanol
SMILESOCc1ccc(Br)cc1F
InChIInChI=1S/C7H6BrFO/c8-6-2-1-5(4-10)7(9)3-6/h1-3,10H,4H2
InChIKeyBWBJZMQPVBWEJU-UHFFFAOYSA-N
MW205.03 g/mol
LogP2.08
Rot. Bonds1

About (4-bromo-2-fluorophenyl)methanol

(4-bromo-2-fluorophenyl)methanol (PubChem CID 2734027) has the molecular formula C7H6BrFO and a molecular weight of 205.03 g/mol. Its IUPAC name is (4-bromo-2-fluorophenyl)methanol.

Molecular Properties

Compound Name(4-bromo-2-fluorophenyl)methanol
PubChem CID2734027
Molecular FormulaC7H6BrFO
Molecular Weight205.03 g/mol
Exact Mass203.96
IUPAC Name(4-bromo-2-fluorophenyl)methanol
SMILESOCc1ccc(Br)cc1F
InChIInChI=1S/C7H6BrFO/c8-6-2-1-5(4-10)7(9)3-6/h1-3,10H,4H2
InChIKeyBWBJZMQPVBWEJU-UHFFFAOYSA-N
XLogP2.08
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.03
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-Bromobenzyl alcohol
CID 70119
2,3-Difluorobenzyl Alcohol
CID 447153
2,4-Difluorobenzyl alcohol
CID 91867
2-Bromobenzyl alcohol
CID 72850
2-Fluorobenzylic alcohol
CID 67969
p-Bromobenzhydryl alcohol
CID 98221
3-Fluorobenzylic alcohol
CID 68008
4-Fluorobenzylic alcohol
CID 68022
2-(4-Bromophenyl)ethanol
CID 72851
1-(4-Bromophenyl)ethanol
CID 95352
3-Bromobenzyl alcohol
CID 85141
1-(2-Bromophenyl)ethanol
CID 95455

Frequently Asked Questions

What is the IUPAC name of (4-bromo-2-fluorophenyl)methanol?
The IUPAC name of (4-bromo-2-fluorophenyl)methanol (CID 2734027) is (4-bromo-2-fluorophenyl)methanol.
What is the SMILES notation for (4-bromo-2-fluorophenyl)methanol?
The canonical SMILES for (4-bromo-2-fluorophenyl)methanol is OCc1ccc(Br)cc1F.
What is the InChIKey of (4-bromo-2-fluorophenyl)methanol?
The InChIKey is BWBJZMQPVBWEJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrFO/c8-6-2-1-5(4-10)7(9)3-6/h1-3,10H,4H2.
What are the key properties of (4-bromo-2-fluorophenyl)methanol?
(4-bromo-2-fluorophenyl)methanol has a molecular weight of 205.03 g/mol, XLogP of 2.08, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromo-2-fluorophenyl)methanol is sourced from PubChem (CID 2734027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).