2-bromophenol;ethane;methoxyethane

C11H19BrO2 — CID 91423114

IUPAC2-bromophenol;ethane;methoxyethane
SMILESCC.CCOC.Oc1ccccc1Br
InChIInChI=1S/C6H5BrO.C3H8O.C2H6/c7-5-3-1-2-4-6(5)8;1-3-4-2;1-2/h1-4,8H;3H2,1-2H3;1-2H3
InChIKeyFWTRIUFSSRXJGF-UHFFFAOYSA-N
MW263.18 g/mol
LogP3.83
Rot. Bonds1

About 2-bromophenol;ethane;methoxyethane

2-bromophenol;ethane;methoxyethane (PubChem CID 91423114) has the molecular formula C11H19BrO2 and a molecular weight of 263.18 g/mol. Its IUPAC name is 2-bromophenol;ethane;methoxyethane.

Molecular Properties

Compound Name2-bromophenol;ethane;methoxyethane
PubChem CID91423114
Molecular FormulaC11H19BrO2
Molecular Weight263.18 g/mol
Exact Mass262.06
IUPAC Name2-bromophenol;ethane;methoxyethane
SMILESCC.CCOC.Oc1ccccc1Br
InChIInChI=1S/C6H5BrO.C3H8O.C2H6/c7-5-3-1-2-4-6(5)8;1-3-4-2;1-2/h1-4,8H;3H2,1-2H3;1-2H3
InChIKeyFWTRIUFSSRXJGF-UHFFFAOYSA-N
XLogP3.83
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.18
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-bromophenol;ethane;methoxyethane?
The IUPAC name of 2-bromophenol;ethane;methoxyethane (CID 91423114) is 2-bromophenol;ethane;methoxyethane.
What is the SMILES notation for 2-bromophenol;ethane;methoxyethane?
The canonical SMILES for 2-bromophenol;ethane;methoxyethane is CC.CCOC.Oc1ccccc1Br.
What is the InChIKey of 2-bromophenol;ethane;methoxyethane?
The InChIKey is FWTRIUFSSRXJGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5BrO.C3H8O.C2H6/c7-5-3-1-2-4-6(5)8;1-3-4-2;1-2/h1-4,8H;3H2,1-2H3;1-2H3.
What are the key properties of 2-bromophenol;ethane;methoxyethane?
2-bromophenol;ethane;methoxyethane has a molecular weight of 263.18 g/mol, XLogP of 3.83, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromophenol;ethane;methoxyethane is sourced from PubChem (CID 91423114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).