ethylcyclohexane;phenol

C14H22O — CID 174842147

IUPACethylcyclohexane;phenol
SMILESCCC1CCCCC1.Oc1ccccc1
InChIInChI=1S/C8H16.C6H6O/c1-2-8-6-4-3-5-7-8;7-6-4-2-1-3-5-6/h8H,2-7H2,1H3;1-5,7H
InChIKeyJCRLURWJOZDLQL-UHFFFAOYSA-N
MW206.33 g/mol
LogP4.37
Rot. Bonds1

About ethylcyclohexane;phenol

ethylcyclohexane;phenol (PubChem CID 174842147) has the molecular formula C14H22O and a molecular weight of 206.33 g/mol. Its IUPAC name is ethylcyclohexane;phenol.

Molecular Properties

Compound Nameethylcyclohexane;phenol
PubChem CID174842147
Molecular FormulaC14H22O
Molecular Weight206.33 g/mol
Exact Mass206.17
IUPAC Nameethylcyclohexane;phenol
SMILESCCC1CCCCC1.Oc1ccccc1
InChIInChI=1S/C8H16.C6H6O/c1-2-8-6-4-3-5-7-8;7-6-4-2-1-3-5-6/h8H,2-7H2,1H3;1-5,7H
InChIKeyJCRLURWJOZDLQL-UHFFFAOYSA-N
XLogP4.37
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethylcyclohexane;phenol?
The IUPAC name of ethylcyclohexane;phenol (CID 174842147) is ethylcyclohexane;phenol.
What is the SMILES notation for ethylcyclohexane;phenol?
The canonical SMILES for ethylcyclohexane;phenol is CCC1CCCCC1.Oc1ccccc1.
What is the InChIKey of ethylcyclohexane;phenol?
The InChIKey is JCRLURWJOZDLQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16.C6H6O/c1-2-8-6-4-3-5-7-8;7-6-4-2-1-3-5-6/h8H,2-7H2,1H3;1-5,7H.
What are the key properties of ethylcyclohexane;phenol?
ethylcyclohexane;phenol has a molecular weight of 206.33 g/mol, XLogP of 4.37, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethylcyclohexane;phenol is sourced from PubChem (CID 174842147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).