2,4-dibromo-6-(1-hydroxyethyl)phenol

C8H8Br2O2 — CID 16769985

IUPAC2,4-dibromo-6-(1-hydroxyethyl)phenol
SMILESCC(O)c1cc(Br)cc(Br)c1O
InChIInChI=1S/C8H8Br2O2/c1-4(11)6-2-5(9)3-7(10)8(6)12/h2-4,11-12H,1H3
InChIKeyHFQGWZWVNAGOCI-UHFFFAOYSA-N
MW295.96 g/mol
LogP2.97
Rot. Bonds1

About 2,4-dibromo-6-(1-hydroxyethyl)phenol

2,4-dibromo-6-(1-hydroxyethyl)phenol (PubChem CID 16769985) has the molecular formula C8H8Br2O2 and a molecular weight of 295.96 g/mol. Its IUPAC name is 2,4-dibromo-6-(1-hydroxyethyl)phenol.

Molecular Properties

Compound Name2,4-dibromo-6-(1-hydroxyethyl)phenol
PubChem CID16769985
Molecular FormulaC8H8Br2O2
Molecular Weight295.96 g/mol
Exact Mass293.89
IUPAC Name2,4-dibromo-6-(1-hydroxyethyl)phenol
SMILESCC(O)c1cc(Br)cc(Br)c1O
InChIInChI=1S/C8H8Br2O2/c1-4(11)6-2-5(9)3-7(10)8(6)12/h2-4,11-12H,1H3
InChIKeyHFQGWZWVNAGOCI-UHFFFAOYSA-N
XLogP2.97
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.96
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dibromo-6-(1-hydroxyethyl)phenol?
The IUPAC name of 2,4-dibromo-6-(1-hydroxyethyl)phenol (CID 16769985) is 2,4-dibromo-6-(1-hydroxyethyl)phenol.
What is the SMILES notation for 2,4-dibromo-6-(1-hydroxyethyl)phenol?
The canonical SMILES for 2,4-dibromo-6-(1-hydroxyethyl)phenol is CC(O)c1cc(Br)cc(Br)c1O.
What is the InChIKey of 2,4-dibromo-6-(1-hydroxyethyl)phenol?
The InChIKey is HFQGWZWVNAGOCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8Br2O2/c1-4(11)6-2-5(9)3-7(10)8(6)12/h2-4,11-12H,1H3.
What are the key properties of 2,4-dibromo-6-(1-hydroxyethyl)phenol?
2,4-dibromo-6-(1-hydroxyethyl)phenol has a molecular weight of 295.96 g/mol, XLogP of 2.97, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dibromo-6-(1-hydroxyethyl)phenol is sourced from PubChem (CID 16769985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).