[4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol

C17H26O2 — CID 63862685

IUPAC[4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol
SMILESCCC1CCCCC1Oc1c(C)cc(CO)cc1C
InChIInChI=1S/C17H26O2/c1-4-15-7-5-6-8-16(15)19-17-12(2)9-14(11-18)10-13(17)3/h9-10,15-16,18H,4-8,11H2,1-3H3
InChIKeyUTYDEAQAFBCWOQ-UHFFFAOYSA-N
MW262.39 g/mol
LogP4.14
Rot. Bonds4

About [4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol

[4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol (PubChem CID 63862685) has the molecular formula C17H26O2 and a molecular weight of 262.39 g/mol. Its IUPAC name is [4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol.

Molecular Properties

Compound Name[4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol
PubChem CID63862685
Molecular FormulaC17H26O2
Molecular Weight262.39 g/mol
Exact Mass262.19
IUPAC Name[4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol
SMILESCCC1CCCCC1Oc1c(C)cc(CO)cc1C
InChIInChI=1S/C17H26O2/c1-4-15-7-5-6-8-16(15)19-17-12(2)9-14(11-18)10-13(17)3/h9-10,15-16,18H,4-8,11H2,1-3H3
InChIKeyUTYDEAQAFBCWOQ-UHFFFAOYSA-N
XLogP4.14
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.39
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol?
The IUPAC name of [4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol (CID 63862685) is [4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol.
What is the SMILES notation for [4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol?
The canonical SMILES for [4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol is CCC1CCCCC1Oc1c(C)cc(CO)cc1C.
What is the InChIKey of [4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol?
The InChIKey is UTYDEAQAFBCWOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O2/c1-4-15-7-5-6-8-16(15)19-17-12(2)9-14(11-18)10-13(17)3/h9-10,15-16,18H,4-8,11H2,1-3H3.
What are the key properties of [4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol?
[4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol has a molecular weight of 262.39 g/mol, XLogP of 4.14, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-ethylcyclohexyl)oxy-3,5-dimethylphenyl]methanol is sourced from PubChem (CID 63862685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).