(5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol

C15H13BrF2O2 — CID 61083035

IUPAC(5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol
SMILESCCOc1ccc(Br)cc1C(O)c1ccc(F)cc1F
InChIInChI=1S/C15H13BrF2O2/c1-2-20-14-6-3-9(16)7-12(14)15(19)11-5-4-10(17)8-13(11)18/h3-8,15,19H,2H2,1H3
InChIKeyMUWXAXWCTIVCQX-UHFFFAOYSA-N
MW343.17 g/mol
LogP4.21
Rot. Bonds4

About (5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol

(5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol (PubChem CID 61083035) has the molecular formula C15H13BrF2O2 and a molecular weight of 343.17 g/mol. Its IUPAC name is (5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol.

Molecular Properties

Compound Name(5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol
PubChem CID61083035
Molecular FormulaC15H13BrF2O2
Molecular Weight343.17 g/mol
Exact Mass342.01
IUPAC Name(5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol
SMILESCCOc1ccc(Br)cc1C(O)c1ccc(F)cc1F
InChIInChI=1S/C15H13BrF2O2/c1-2-20-14-6-3-9(16)7-12(14)15(19)11-5-4-10(17)8-13(11)18/h3-8,15,19H,2H2,1H3
InChIKeyMUWXAXWCTIVCQX-UHFFFAOYSA-N
XLogP4.21
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.17
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-bromo-2-ethoxyphenyl)-(5-bromo-2-methylphenyl)methanol
CID 65306945
(2-bromo-4-chlorophenyl)-(5-bromo-2-ethoxyphenyl)methanol
CID 107991194
(5-bromo-2-ethoxyphenyl)-(4-bromophenyl)methanol
CID 61081643
(4-bromo-2-methylphenyl)-(2,4-difluorophenyl)methanol
CID 61087729
4-bromo-1-[(5-bromo-2-ethoxyphenyl)-chloromethyl]-2-fluorobenzene
CID 63434442
2-[bromo-(5-bromo-2-ethoxyphenyl)methyl]-1,3,5-trifluorobenzene
CID 65100839
(5-bromo-2-ethoxyphenyl)-(2-iodophenyl)methanol
CID 61081064
(4-bromo-2-methylphenyl)-(2-ethoxy-5-methylphenyl)methanol
CID 62302334
(4-bromo-2-chlorophenyl)-(2,4-difluorophenyl)methanol
CID 61087730
(2,4-dibromophenyl)-(2-ethoxyphenyl)methanol
CID 107947466
(5-bromo-2-ethoxyphenyl)-(3-bromophenyl)methanol
CID 61082247
1-[(5-bromo-2-ethoxyphenyl)-chloromethyl]-4-chloro-2-fluorobenzene
CID 63434698

Frequently Asked Questions

What is the IUPAC name of (5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol?
The IUPAC name of (5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol (CID 61083035) is (5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol.
What is the SMILES notation for (5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol?
The canonical SMILES for (5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol is CCOc1ccc(Br)cc1C(O)c1ccc(F)cc1F.
What is the InChIKey of (5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol?
The InChIKey is MUWXAXWCTIVCQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrF2O2/c1-2-20-14-6-3-9(16)7-12(14)15(19)11-5-4-10(17)8-13(11)18/h3-8,15,19H,2H2,1H3.
What are the key properties of (5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol?
(5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol has a molecular weight of 343.17 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromo-2-ethoxyphenyl)-(2,4-difluorophenyl)methanol is sourced from PubChem (CID 61083035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).