2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol

C14H22O2 — CID 117318714

IUPAC2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol
SMILESCC(C)c1ccc(C(C)C)c(CCO)c1O
InChIInChI=1S/C14H22O2/c1-9(2)11-5-6-12(10(3)4)14(16)13(11)7-8-15/h5-6,9-10,15-16H,7-8H2,1-4H3
InChIKeyCFOXLEKBYIIWKZ-UHFFFAOYSA-N
MW222.33 g/mol
LogP3.17
Rot. Bonds4

About 2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol

2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol (PubChem CID 117318714) has the molecular formula C14H22O2 and a molecular weight of 222.33 g/mol. Its IUPAC name is 2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol.

Molecular Properties

Compound Name2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol
PubChem CID117318714
Molecular FormulaC14H22O2
Molecular Weight222.33 g/mol
Exact Mass222.16
IUPAC Name2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol
SMILESCC(C)c1ccc(C(C)C)c(CCO)c1O
InChIInChI=1S/C14H22O2/c1-9(2)11-5-6-12(10(3)4)14(16)13(11)7-8-15/h5-6,9-10,15-16H,7-8H2,1-4H3
InChIKeyCFOXLEKBYIIWKZ-UHFFFAOYSA-N
XLogP3.17
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-3-methyl-6-propan-2-ylphenol
CID 141031385
2-(4-aminobutyl)-3-methyl-6-propan-2-ylphenol
CID 117317044
3-(2-hydroxy-3-methyl-6-propan-2-ylphenyl)propanoic acid
CID 84687629
2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol
CID 84666960
3-butan-2-yl-6-propan-2-ylbenzene-1,2-diol
CID 146417092
2-(piperidin-4-ylmethyl)-3,6-di(propan-2-yl)phenol
CID 117441142
2-(3-aminopropyl)-6-ethyl-3-propan-2-ylphenol
CID 117316995
1-(2-hydroxy-6-methyl-3-propan-2-ylphenyl)propan-2-one
CID 84674442
3-(2-hydroxy-3-methoxy-6-propan-2-ylphenyl)propanal
CID 117318262
2-[bis(2-hydroxyethyl)amino]ethanol;2,6-di(propan-2-yl)phenol;titanium
CID 11210933
2,6-di(propan-2-yl)phenol;silver
CID 174803720
2,3-bis(2-methylpropyl)-4-propan-2-ylphenol
CID 139802113

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol?
The IUPAC name of 2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol (CID 117318714) is 2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol.
What is the SMILES notation for 2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol?
The canonical SMILES for 2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol is CC(C)c1ccc(C(C)C)c(CCO)c1O.
What is the InChIKey of 2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol?
The InChIKey is CFOXLEKBYIIWKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O2/c1-9(2)11-5-6-12(10(3)4)14(16)13(11)7-8-15/h5-6,9-10,15-16H,7-8H2,1-4H3.
What are the key properties of 2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol?
2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol has a molecular weight of 222.33 g/mol, XLogP of 3.17, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol is sourced from PubChem (CID 117318714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).