2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol

C11H15ClO2 — CID 117306101

IUPAC2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol
SMILESCCc1cc(OC)c(Cl)cc1CCO
InChIInChI=1S/C11H15ClO2/c1-3-8-7-11(14-2)10(12)6-9(8)4-5-13/h6-7,13H,3-5H2,1-2H3
InChIKeyKPLAVZXISRUHEO-UHFFFAOYSA-N
MW214.69 g/mol
LogP2.45
Rot. Bonds4

About 2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol

2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol (PubChem CID 117306101) has the molecular formula C11H15ClO2 and a molecular weight of 214.69 g/mol. Its IUPAC name is 2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol.

Molecular Properties

Compound Name2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol
PubChem CID117306101
Molecular FormulaC11H15ClO2
Molecular Weight214.69 g/mol
Exact Mass214.08
IUPAC Name2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol
SMILESCCc1cc(OC)c(Cl)cc1CCO
InChIInChI=1S/C11H15ClO2/c1-3-8-7-11(14-2)10(12)6-9(8)4-5-13/h6-7,13H,3-5H2,1-2H3
InChIKeyKPLAVZXISRUHEO-UHFFFAOYSA-N
XLogP2.45
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.69
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-chloro-2-ethyl-4-methoxyphenyl)methanol
CID 84669748
4-(5-chloro-2-ethyl-4-methoxyphenyl)butanoic acid
CID 117395261
5-chloro-2-(2-hydroxyethyl)-4-methoxyphenol
CID 117291172
1-chloro-4-ethyl-2,5-dimethoxybenzene
CID 71132798
3-[5-chloro-4-methoxy-2-(methoxymethyl)phenyl]propan-1-ol
CID 117363855
2-(3-chloro-2-ethyl-4,5-dimethoxyphenyl)ethanol
CID 117363854
(2-ethyl-4,5-dimethoxyphenyl)methanol
CID 14094580
2-(2-chloro-5-methoxy-4-nitrophenyl)ethanol
CID 67469173
2-(5-chloro-2-ethyl-4-methoxyphenyl)-2-oxoacetic acid
CID 117358488
2-(2,5-dichloro-4-methoxyphenyl)acetic acid
CID 5202225
(2-amino-4-chloro-5-methoxyphenyl)methanol
CID 130139409
3-chloro-4-ethyl-2-(3-hydroxypropyl)-6-methoxyphenol
CID 117363864

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol?
The IUPAC name of 2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol (CID 117306101) is 2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol.
What is the SMILES notation for 2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol?
The canonical SMILES for 2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol is CCc1cc(OC)c(Cl)cc1CCO.
What is the InChIKey of 2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol?
The InChIKey is KPLAVZXISRUHEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClO2/c1-3-8-7-11(14-2)10(12)6-9(8)4-5-13/h6-7,13H,3-5H2,1-2H3.
What are the key properties of 2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol?
2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol has a molecular weight of 214.69 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-ethyl-4-methoxyphenyl)ethanol is sourced from PubChem (CID 117306101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).