2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol

C15H24O3 — CID 114208512

IUPAC2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol
SMILESCCC(CC)COCC(O)c1ccc(OC)cc1
InChIInChI=1S/C15H24O3/c1-4-12(5-2)10-18-11-15(16)13-6-8-14(17-3)9-7-13/h6-9,12,15-16H,4-5,10-11H2,1-3H3
InChIKeyYSNJQYFZXJUIGV-UHFFFAOYSA-N
MW252.35 g/mol
LogP3.18
Rot. Bonds8

About 2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol

2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol (PubChem CID 114208512) has the molecular formula C15H24O3 and a molecular weight of 252.35 g/mol. Its IUPAC name is 2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol.

Molecular Properties

Compound Name2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol
PubChem CID114208512
Molecular FormulaC15H24O3
Molecular Weight252.35 g/mol
Exact Mass252.17
IUPAC Name2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol
SMILESCCC(CC)COCC(O)c1ccc(OC)cc1
InChIInChI=1S/C15H24O3/c1-4-12(5-2)10-18-11-15(16)13-6-8-14(17-3)9-7-13/h6-9,12,15-16H,4-5,10-11H2,1-3H3
InChIKeyYSNJQYFZXJUIGV-UHFFFAOYSA-N
XLogP3.18
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.35
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-1-(4-methoxyphenyl)pentan-1-ol
CID 82920608
1-methoxy-4-[1-[2-(4-methoxyphenyl)butoxy]butan-2-yl]benzene
CID 139824565
1-(4-methoxyphenyl)(213C)ethane-1,2-diol
CID 101170566
1-(4-methoxyphenyl)pentan-1-ol
CID 10176510
[2-hydroxy-2-(4-methoxyphenyl)ethyl] acetate
CID 13275342
4-[1-hydroxy-2-(4-methoxyphenoxy)ethyl]phenol
CID 117244685
2-chloro-1-(4-methoxyphenyl)ethanol
CID 12862876
(1S)-1-(4-methoxyphenyl)hexan-1-ol
CID 102325483
(1R,3S)-1-(4-methoxyphenyl)butane-1,3-diol
CID 101493823
(1S)-1-(4-methoxyphenyl)nonan-1-ol
CID 15156207
2-(butan-2-ylamino)-1-(4-methoxyphenyl)ethanol
CID 60904151
(1R)-3,3-dimethoxy-1-(4-methoxyphenyl)propan-1-ol
CID 11572126

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol?
The IUPAC name of 2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol (CID 114208512) is 2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol.
What is the SMILES notation for 2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol?
The canonical SMILES for 2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol is CCC(CC)COCC(O)c1ccc(OC)cc1.
What is the InChIKey of 2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol?
The InChIKey is YSNJQYFZXJUIGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O3/c1-4-12(5-2)10-18-11-15(16)13-6-8-14(17-3)9-7-13/h6-9,12,15-16H,4-5,10-11H2,1-3H3.
What are the key properties of 2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol?
2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol has a molecular weight of 252.35 g/mol, XLogP of 3.18, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylbutoxy)-1-(4-methoxyphenyl)ethanol is sourced from PubChem (CID 114208512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).