6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol

C16H24O3 — CID 79847470

IUPAC6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol
SMILESCCOc1cccc(OC2CCCC(C)(C)C2O)c1
InChIInChI=1S/C16H24O3/c1-4-18-12-7-5-8-13(11-12)19-14-9-6-10-16(2,3)15(14)17/h5,7-8,11,14-15,17H,4,6,9-10H2,1-3H3
InChIKeyHAKWEWSJKSASAC-UHFFFAOYSA-N
MW264.37 g/mol
LogP3.40
Rot. Bonds4

About 6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol

6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol (PubChem CID 79847470) has the molecular formula C16H24O3 and a molecular weight of 264.37 g/mol. Its IUPAC name is 6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol.

Molecular Properties

Compound Name6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol
PubChem CID79847470
Molecular FormulaC16H24O3
Molecular Weight264.37 g/mol
Exact Mass264.17
IUPAC Name6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol
SMILESCCOc1cccc(OC2CCCC(C)(C)C2O)c1
InChIInChI=1S/C16H24O3/c1-4-18-12-7-5-8-13(11-12)19-14-9-6-10-16(2,3)15(14)17/h5,7-8,11,14-15,17H,4,6,9-10H2,1-3H3
InChIKeyHAKWEWSJKSASAC-UHFFFAOYSA-N
XLogP3.40
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(2,3-dihydro-1H-inden-5-yloxy)-2,2-dimethylcyclohexan-1-ol
CID 79846941
7-(3-ethoxyphenoxy)-1,4-dioxaspiro[4.5]decan-8-ol
CID 62336910
6-(4-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-amine
CID 79836385
4-(3-ethoxyphenoxy)pyrrolidin-3-ol
CID 63704227
2-(3-ethoxyphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 62336546
[1-amino-3-(3-ethoxyphenoxy)cyclohexyl]methanol
CID 79640484
2,2-dimethyl-6-(2-methylphenoxy)cyclohexan-1-ol
CID 79847908
2,2-dimethyl-6-(3-methylphenoxy)cyclohexan-1-amine
CID 79835658
N-ethyl-6-(3-fluorophenoxy)-2,2-dimethylcyclohexan-1-amine
CID 79837063
6-(3-fluorophenoxy)-2,2-dimethylcyclohexan-1-amine
CID 79836584
6-(2,4-dimethylphenoxy)-2,2-dimethylcyclohexan-1-ol
CID 79847464
2-ethoxy-3-(3-ethoxyphenoxy)cyclobutan-1-amine
CID 113440032

Frequently Asked Questions

What is the IUPAC name of 6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol?
The IUPAC name of 6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol (CID 79847470) is 6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol.
What is the SMILES notation for 6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol?
The canonical SMILES for 6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol is CCOc1cccc(OC2CCCC(C)(C)C2O)c1.
What is the InChIKey of 6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol?
The InChIKey is HAKWEWSJKSASAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O3/c1-4-18-12-7-5-8-13(11-12)19-14-9-6-10-16(2,3)15(14)17/h5,7-8,11,14-15,17H,4,6,9-10H2,1-3H3.
What are the key properties of 6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol?
6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol has a molecular weight of 264.37 g/mol, XLogP of 3.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-ethoxyphenoxy)-2,2-dimethylcyclohexan-1-ol is sourced from PubChem (CID 79847470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).