1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol

C14H28O2 — CID 105103646

IUPAC1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
SMILESCCC1CCC(C(O)COC(C)(C)C)CC1
InChIInChI=1S/C14H28O2/c1-5-11-6-8-12(9-7-11)13(15)10-16-14(2,3)4/h11-13,15H,5-10H2,1-4H3
InChIKeyAOAFTFWMRKBVDK-UHFFFAOYSA-N
MW228.38 g/mol
LogP3.38
Rot. Bonds4

About 1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol

1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol (PubChem CID 105103646) has the molecular formula C14H28O2 and a molecular weight of 228.38 g/mol. Its IUPAC name is 1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol.

Molecular Properties

Compound Name1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
PubChem CID105103646
Molecular FormulaC14H28O2
Molecular Weight228.38 g/mol
Exact Mass228.21
IUPAC Name1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
SMILESCCC1CCC(C(O)COC(C)(C)C)CC1
InChIInChI=1S/C14H28O2/c1-5-11-6-8-12(9-7-11)13(15)10-16-14(2,3)4/h11-13,15H,5-10H2,1-4H3
InChIKeyAOAFTFWMRKBVDK-UHFFFAOYSA-N
XLogP3.38
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(l-Menthoxy)ethanol
CID 10219851
2-tert-Butylcyclohexyloxybutanol
CID 164422
Poly(oxy-1,2-ethanediyl), alpha-(3,5-dimethyl-1-(2-methylpropyl)hexyl)-omega-hydroxy-
CID 24982
3-((L-Menthyl)oxy)propane-1,2-diol
CID 6850757
3-(l-Menthoxy)-2-methylpropane-1,2-diol
CID 9834711
3,7-Dimethyl-7-methoxyoctan-2-ol
CID 162053
2-(Menthoxy)ethanol
CID 14064911
Menthoxypropanediol
CID 5362595
Cyclohexanol, 2-methoxy-4-propyl-
CID 91098
2-(2,4,6-Trimethylnonan-4-yloxy)ethanol
CID 92036233
3-((2-Isopropyl-5-methylcyclohexyl)oxy)-2-methylpropane-1,2-diol
CID 16734862
(1-Methoxycyclohexyl)methanol
CID 21895925

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol?
The IUPAC name of 1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol (CID 105103646) is 1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol.
What is the SMILES notation for 1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol?
The canonical SMILES for 1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol is CCC1CCC(C(O)COC(C)(C)C)CC1.
What is the InChIKey of 1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol?
The InChIKey is AOAFTFWMRKBVDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O2/c1-5-11-6-8-12(9-7-11)13(15)10-16-14(2,3)4/h11-13,15H,5-10H2,1-4H3.
What are the key properties of 1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol?
1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol has a molecular weight of 228.38 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol is sourced from PubChem (CID 105103646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).