(1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol

C14H11Cl2FO2 — CID 63372482

IUPAC(1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol
SMILESC[C@@H](O)c1cc(F)ccc1Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H11Cl2FO2/c1-8(18)11-7-10(17)3-5-13(11)19-14-4-2-9(15)6-12(14)16/h2-8,18H,1H3/t8-/m1/s1
InChIKeyGMOYCDIQWPJKLM-MRVPVSSYSA-N
MW301.14 g/mol
LogP4.98
Rot. Bonds3

About (1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol

(1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol (PubChem CID 63372482) has the molecular formula C14H11Cl2FO2 and a molecular weight of 301.14 g/mol. Its IUPAC name is (1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol
PubChem CID63372482
Molecular FormulaC14H11Cl2FO2
Molecular Weight301.14 g/mol
Exact Mass300.01
IUPAC Name(1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol
SMILESC[C@@H](O)c1cc(F)ccc1Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H11Cl2FO2/c1-8(18)11-7-10(17)3-5-13(11)19-14-4-2-9(15)6-12(14)16/h2-8,18H,1H3/t8-/m1/s1
InChIKeyGMOYCDIQWPJKLM-MRVPVSSYSA-N
XLogP4.98
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.14
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-[2-(2-chloro-4-fluorophenoxy)-5-fluorophenyl]ethanol
CID 55184876
(1S)-1-[2-(2,5-dichlorophenoxy)-5-fluorophenyl]ethanol
CID 55183586
(1R)-1-[2-(2-chloro-4-methylphenoxy)-5-fluorophenyl]ethanol
CID 63374690
(1R)-1-[2-(2-chloro-4-fluorophenoxy)phenyl]ethanol
CID 78941796
1-[5-bromo-2-(2-chloro-4-fluorophenoxy)phenyl]ethanol
CID 82970752
1-[2-(3-chloro-2-fluorophenoxy)-5-fluorophenyl]ethanol
CID 116689382
(1S)-1-[2-(5-bromo-2-chlorophenoxy)-5-fluorophenyl]ethanol
CID 78955958
1-[4-bromo-2-(2-chloro-4-fluorophenoxy)phenyl]ethanol
CID 82970825
(1S)-1-[2-[(5-chloro-3-pyridinyl)oxy]-5-fluorophenyl]ethanol
CID 78996799
1-[5-fluoro-2-(2-methoxy-4-methylphenoxy)phenyl]ethanol
CID 43506272
(1S)-1-[2-(2-bromophenoxy)-5-fluorophenyl]ethanol
CID 78941416
(1R)-1-(5-fluoro-2-methoxyphenyl)ethanol
CID 26597266

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol?
The IUPAC name of (1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol (CID 63372482) is (1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol.
What is the SMILES notation for (1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol?
The canonical SMILES for (1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol is C[C@@H](O)c1cc(F)ccc1Oc1ccc(Cl)cc1Cl.
What is the InChIKey of (1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol?
The InChIKey is GMOYCDIQWPJKLM-MRVPVSSYSA-N. The full InChI is InChI=1S/C14H11Cl2FO2/c1-8(18)11-7-10(17)3-5-13(11)19-14-4-2-9(15)6-12(14)16/h2-8,18H,1H3/t8-/m1/s1.
What are the key properties of (1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol?
(1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol has a molecular weight of 301.14 g/mol, XLogP of 4.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-(2,4-dichlorophenoxy)-5-fluorophenyl]ethanol is sourced from PubChem (CID 63372482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).