2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol

C14H22O2 — CID 117318735

IUPAC2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol
SMILESCC(C)c1ccc(C(C)C)c(C(C)O)c1O
InChIInChI=1S/C14H22O2/c1-8(2)11-6-7-12(9(3)4)14(16)13(11)10(5)15/h6-10,15-16H,1-5H3
InChIKeyJKPCWBONDWKSPV-UHFFFAOYSA-N
MW222.33 g/mol
LogP3.69
Rot. Bonds3

About 2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol

2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol (PubChem CID 117318735) has the molecular formula C14H22O2 and a molecular weight of 222.33 g/mol. Its IUPAC name is 2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol.

Molecular Properties

Compound Name2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol
PubChem CID117318735
Molecular FormulaC14H22O2
Molecular Weight222.33 g/mol
Exact Mass222.16
IUPAC Name2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol
SMILESCC(C)c1ccc(C(C)C)c(C(C)O)c1O
InChIInChI=1S/C14H22O2/c1-8(2)11-6-7-12(9(3)4)14(16)13(11)10(5)15/h6-10,15-16H,1-5H3
InChIKeyJKPCWBONDWKSPV-UHFFFAOYSA-N
XLogP3.69
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-hydroxy-2-[2-hydroxy-3,6-di(propan-2-yl)phenyl]acetate
CID 117420065
sodium 2-hydroxy-3,4-di(propan-2-yl)benzoate
CID 159643835
2,6-di(propan-2-yl)phenol;silver
CID 174803720
3-butan-2-yl-6-propan-2-ylbenzene-1,2-diol
CID 146417092
bis(2,6-di(propan-2-yl)phenol);titanium(2+);dichloride
CID 87638376
bis(2,6-di(propan-2-yl)phenol);titanium;dihydrochloride
CID 87638377
2-(2-amino-1-hydroxyethyl)-6-methyl-3-propan-2-ylphenol
CID 84677143
1-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)ethanol
CID 117318734
2-fluoro-6-(1-hydroxyethyl)-3-methylphenol
CID 117276805
2-fluoro-4-(1-hydroxyethyl)benzene-1,3-diol
CID 117276916
3-fluoro-2,4-di(propan-2-yl)phenol
CID 174716434
dimethylalumane;tris(2,6-di(propan-2-yl)phenol)
CID 173121880

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol?
The IUPAC name of 2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol (CID 117318735) is 2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol.
What is the SMILES notation for 2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol?
The canonical SMILES for 2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol is CC(C)c1ccc(C(C)C)c(C(C)O)c1O.
What is the InChIKey of 2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol?
The InChIKey is JKPCWBONDWKSPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O2/c1-8(2)11-6-7-12(9(3)4)14(16)13(11)10(5)15/h6-10,15-16H,1-5H3.
What are the key properties of 2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol?
2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol has a molecular weight of 222.33 g/mol, XLogP of 3.69, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxyethyl)-3,6-di(propan-2-yl)phenol is sourced from PubChem (CID 117318735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).