2-(3-chloro-5-fluorophenyl)ethanol

C8H8ClFO — CID 2757560

IUPAC2-(3-chloro-5-fluorophenyl)ethanol
SMILESOCCc1cc(F)cc(Cl)c1
InChIInChI=1S/C8H8ClFO/c9-7-3-6(1-2-11)4-8(10)5-7/h3-5,11H,1-2H2
InChIKeyVIKUMBPQNUJMOW-UHFFFAOYSA-N
MW174.60 g/mol
LogP2.01
Rot. Bonds2

About 2-(3-chloro-5-fluorophenyl)ethanol

2-(3-chloro-5-fluorophenyl)ethanol (PubChem CID 2757560) has the molecular formula C8H8ClFO and a molecular weight of 174.60 g/mol. Its IUPAC name is 2-(3-chloro-5-fluorophenyl)ethanol.

Molecular Properties

Compound Name2-(3-chloro-5-fluorophenyl)ethanol
PubChem CID2757560
Molecular FormulaC8H8ClFO
Molecular Weight174.60 g/mol
Exact Mass174.02
IUPAC Name2-(3-chloro-5-fluorophenyl)ethanol
SMILESOCCc1cc(F)cc(Cl)c1
InChIInChI=1S/C8H8ClFO/c9-7-3-6(1-2-11)4-8(10)5-7/h3-5,11H,1-2H2
InChIKeyVIKUMBPQNUJMOW-UHFFFAOYSA-N
XLogP2.01
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.60
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 70117
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CID 82068
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(1R)-1-(3-chlorophenyl)propan-1-ol
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m-Chlorophenethylic alcohol
CID 78856
o-Chlorophenethylic alcohol
CID 88266
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2-(3-Fluorophenyl)ethanol
CID 573132
2-(2-Fluorophenyl)ethan-1-ol
CID 2733296

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-5-fluorophenyl)ethanol?
The IUPAC name of 2-(3-chloro-5-fluorophenyl)ethanol (CID 2757560) is 2-(3-chloro-5-fluorophenyl)ethanol.
What is the SMILES notation for 2-(3-chloro-5-fluorophenyl)ethanol?
The canonical SMILES for 2-(3-chloro-5-fluorophenyl)ethanol is OCCc1cc(F)cc(Cl)c1.
What is the InChIKey of 2-(3-chloro-5-fluorophenyl)ethanol?
The InChIKey is VIKUMBPQNUJMOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClFO/c9-7-3-6(1-2-11)4-8(10)5-7/h3-5,11H,1-2H2.
What are the key properties of 2-(3-chloro-5-fluorophenyl)ethanol?
2-(3-chloro-5-fluorophenyl)ethanol has a molecular weight of 174.60 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-5-fluorophenyl)ethanol is sourced from PubChem (CID 2757560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).