2-bromo-3-(2-hydroxyethyl)phenol

C8H9BrO2 — CID 141056029

IUPAC2-bromo-3-(2-hydroxyethyl)phenol
SMILESOCCc1cccc(O)c1Br
InChIInChI=1S/C8H9BrO2/c9-8-6(4-5-10)2-1-3-7(8)11/h1-3,10-11H,4-5H2
InChIKeyJNMFKJCQFMTORT-UHFFFAOYSA-N
MW217.06 g/mol
LogP1.69
Rot. Bonds2

About 2-bromo-3-(2-hydroxyethyl)phenol

2-bromo-3-(2-hydroxyethyl)phenol (PubChem CID 141056029) has the molecular formula C8H9BrO2 and a molecular weight of 217.06 g/mol. Its IUPAC name is 2-bromo-3-(2-hydroxyethyl)phenol.

Molecular Properties

Compound Name2-bromo-3-(2-hydroxyethyl)phenol
PubChem CID141056029
Molecular FormulaC8H9BrO2
Molecular Weight217.06 g/mol
Exact Mass215.98
IUPAC Name2-bromo-3-(2-hydroxyethyl)phenol
SMILESOCCc1cccc(O)c1Br
InChIInChI=1S/C8H9BrO2/c9-8-6(4-5-10)2-1-3-7(8)11/h1-3,10-11H,4-5H2
InChIKeyJNMFKJCQFMTORT-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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Related Compounds

2-bromo-6-(2-hydroxyethyl)phenol
CID 57283538
2-bromo-3-hexadecylphenol
CID 141212813
2-(2-hydroxyethyl)-6-(hydroxymethyl)phenol
CID 117276602
2-(3-bromo-2-fluorophenyl)ethanol
CID 59290439
3-[(2R)-2-aminopropyl]-2-bromophenol
CID 130742864
3,4-dibromo-5-(2-hydroxyethyl)benzene-1,2-diol
CID 11500585
2-(1,3-dihydro-2-benzofuran-4-yl)ethanol
CID 83674155
2-(2-bromo-1,3-benzothiazol-4-yl)ethanol
CID 18984453
2-bromo-6-(2-hydroxyethyl)benzonitrile
CID 141425124
2-(2-bromo-3-pyridinyl)ethanol
CID 87594301
2-[5-(2-hydroxyethyl)phenanthren-4-yl]ethanol
CID 87369855
2-[2-(aminomethyl)-3-(2-hydroxyethyl)phenyl]ethanol
CID 23064642

Frequently Asked Questions

What is the IUPAC name of 2-bromo-3-(2-hydroxyethyl)phenol?
The IUPAC name of 2-bromo-3-(2-hydroxyethyl)phenol (CID 141056029) is 2-bromo-3-(2-hydroxyethyl)phenol.
What is the SMILES notation for 2-bromo-3-(2-hydroxyethyl)phenol?
The canonical SMILES for 2-bromo-3-(2-hydroxyethyl)phenol is OCCc1cccc(O)c1Br.
What is the InChIKey of 2-bromo-3-(2-hydroxyethyl)phenol?
The InChIKey is JNMFKJCQFMTORT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9BrO2/c9-8-6(4-5-10)2-1-3-7(8)11/h1-3,10-11H,4-5H2.
What are the key properties of 2-bromo-3-(2-hydroxyethyl)phenol?
2-bromo-3-(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-3-(2-hydroxyethyl)phenol is sourced from PubChem (CID 141056029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).