2-bromo-6-(2-hydroxyethyl)phenol

C8H9BrO2 — CID 57283538

IUPAC2-bromo-6-(2-hydroxyethyl)phenol
SMILESOCCc1cccc(Br)c1O
InChIInChI=1S/C8H9BrO2/c9-7-3-1-2-6(4-5-10)8(7)11/h1-3,10-11H,4-5H2
InChIKeySSMUMAPJKJESGV-UHFFFAOYSA-N
MW217.06 g/mol
LogP1.69
Rot. Bonds2

About 2-bromo-6-(2-hydroxyethyl)phenol

2-bromo-6-(2-hydroxyethyl)phenol (PubChem CID 57283538) has the molecular formula C8H9BrO2 and a molecular weight of 217.06 g/mol. Its IUPAC name is 2-bromo-6-(2-hydroxyethyl)phenol.

Molecular Properties

Compound Name2-bromo-6-(2-hydroxyethyl)phenol
PubChem CID57283538
Molecular FormulaC8H9BrO2
Molecular Weight217.06 g/mol
Exact Mass215.98
IUPAC Name2-bromo-6-(2-hydroxyethyl)phenol
SMILESOCCc1cccc(Br)c1O
InChIInChI=1S/C8H9BrO2/c9-7-3-1-2-6(4-5-10)8(7)11/h1-3,10-11H,4-5H2
InChIKeySSMUMAPJKJESGV-UHFFFAOYSA-N
XLogP1.69
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.06
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-(2-hydroxyethyl)phenol?
The IUPAC name of 2-bromo-6-(2-hydroxyethyl)phenol (CID 57283538) is 2-bromo-6-(2-hydroxyethyl)phenol.
What is the SMILES notation for 2-bromo-6-(2-hydroxyethyl)phenol?
The canonical SMILES for 2-bromo-6-(2-hydroxyethyl)phenol is OCCc1cccc(Br)c1O.
What is the InChIKey of 2-bromo-6-(2-hydroxyethyl)phenol?
The InChIKey is SSMUMAPJKJESGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9BrO2/c9-7-3-1-2-6(4-5-10)8(7)11/h1-3,10-11H,4-5H2.
What are the key properties of 2-bromo-6-(2-hydroxyethyl)phenol?
2-bromo-6-(2-hydroxyethyl)phenol has a molecular weight of 217.06 g/mol, XLogP of 1.69, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-(2-hydroxyethyl)phenol is sourced from PubChem (CID 57283538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).