2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol

C8H8ClFO2 — CID 84662920

IUPAC2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol
SMILESCC(O)c1cc(Cl)c(O)cc1F
InChIInChI=1S/C8H8ClFO2/c1-4(11)5-2-6(9)8(12)3-7(5)10/h2-4,11-12H,1H3
InChIKeyALRNXJUNUYOMJE-UHFFFAOYSA-N
MW190.60 g/mol
LogP2.24
Rot. Bonds1

About 2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol

2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol (PubChem CID 84662920) has the molecular formula C8H8ClFO2 and a molecular weight of 190.60 g/mol. Its IUPAC name is 2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol.

Molecular Properties

Compound Name2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol
PubChem CID84662920
Molecular FormulaC8H8ClFO2
Molecular Weight190.60 g/mol
Exact Mass190.02
IUPAC Name2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol
SMILESCC(O)c1cc(Cl)c(O)cc1F
InChIInChI=1S/C8H8ClFO2/c1-4(11)5-2-6(9)8(12)3-7(5)10/h2-4,11-12H,1H3
InChIKeyALRNXJUNUYOMJE-UHFFFAOYSA-N
XLogP2.24
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.60
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-chloro-2,4-difluorophenyl)ethanol
CID 117283331
2-bromo-5-fluoro-4-(1-hydroxyethyl)phenol
CID 84698228
4-fluoro-5-(1-hydroxyethyl)-2-methylphenol
CID 117276801
4-chloro-5-fluoro-2-(2-hydroxypropyl)phenol
CID 117293006
sodium 2-(5-chloro-2-fluoro-4-hydroxyphenyl)-2-hydroxyacetate
CID 56840544
6-chloro-2,3-difluoro-4-(1-hydroxyethyl)phenol
CID 117298062
2-chloro-5-fluorobenzene-1,4-diol
CID 45119169
(1S)-1-(2,4-difluoro-5-methylphenyl)ethanol
CID 82759306
2-(1-aminopropan-2-yl)-4-chloro-5-fluorophenol
CID 84777609
4-chloro-2-(difluoromethyl)-5-fluorophenol
CID 84667188
(1R)-1-(2-bromo-4-chloro-5-fluorophenyl)ethanol
CID 58572415
2,5-dichloro-4-fluorophenol
CID 3535760

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol?
The IUPAC name of 2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol (CID 84662920) is 2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol.
What is the SMILES notation for 2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol?
The canonical SMILES for 2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol is CC(O)c1cc(Cl)c(O)cc1F.
What is the InChIKey of 2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol?
The InChIKey is ALRNXJUNUYOMJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClFO2/c1-4(11)5-2-6(9)8(12)3-7(5)10/h2-4,11-12H,1H3.
What are the key properties of 2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol?
2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol has a molecular weight of 190.60 g/mol, XLogP of 2.24, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-fluoro-4-(1-hydroxyethyl)phenol is sourced from PubChem (CID 84662920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).