2-tert-butyl-4-(2-hydroxyethoxy)phenol

C12H18O3 — CID 18353567

IUPAC2-tert-butyl-4-(2-hydroxyethoxy)phenol
SMILESCC(C)(C)c1cc(OCCO)ccc1O
InChIInChI=1S/C12H18O3/c1-12(2,3)10-8-9(15-7-6-13)4-5-11(10)14/h4-5,8,13-14H,6-7H2,1-3H3
InChIKeyUHMONBNAXZUHPY-UHFFFAOYSA-N
MW210.27 g/mol
LogP2.06
Rot. Bonds3

About 2-tert-butyl-4-(2-hydroxyethoxy)phenol

2-tert-butyl-4-(2-hydroxyethoxy)phenol (PubChem CID 18353567) has the molecular formula C12H18O3 and a molecular weight of 210.27 g/mol. Its IUPAC name is 2-tert-butyl-4-(2-hydroxyethoxy)phenol.

Molecular Properties

Compound Name2-tert-butyl-4-(2-hydroxyethoxy)phenol
PubChem CID18353567
Molecular FormulaC12H18O3
Molecular Weight210.27 g/mol
Exact Mass210.13
IUPAC Name2-tert-butyl-4-(2-hydroxyethoxy)phenol
SMILESCC(C)(C)c1cc(OCCO)ccc1O
InChIInChI=1S/C12H18O3/c1-12(2,3)10-8-9(15-7-6-13)4-5-11(10)14/h4-5,8,13-14H,6-7H2,1-3H3
InChIKeyUHMONBNAXZUHPY-UHFFFAOYSA-N
XLogP2.06
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.27
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Butylated Hydroxyanisole
CID 8456
Mephenesin
CID 4059
Tocotrienol
CID 9929901
Triton X 100
CID 5590
2-(4-(1,1-Dimethylethyl)phenoxy)cyclohexanol
CID 16033
2,6-Di-tert-butyl-4-methoxyphenol
CID 10269
Hthq
CID 119193
2-tert-Butyl-4-hydroxyanisole
CID 6932
2-(p-Nonylphenoxy)ethanol
CID 7700
Poly(oxy-1,2-ethanediyl), alpha-((1,1,3,3-tetramethylbutyl)phenyl)-omega-hydroxy-, potassium salt (1:1)
CID 24775
Deoxy-HU210
CID 9799540
Bisphenol A bis(2-hydroxyethyl)ether
CID 61909

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-4-(2-hydroxyethoxy)phenol?
The IUPAC name of 2-tert-butyl-4-(2-hydroxyethoxy)phenol (CID 18353567) is 2-tert-butyl-4-(2-hydroxyethoxy)phenol.
What is the SMILES notation for 2-tert-butyl-4-(2-hydroxyethoxy)phenol?
The canonical SMILES for 2-tert-butyl-4-(2-hydroxyethoxy)phenol is CC(C)(C)c1cc(OCCO)ccc1O.
What is the InChIKey of 2-tert-butyl-4-(2-hydroxyethoxy)phenol?
The InChIKey is UHMONBNAXZUHPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O3/c1-12(2,3)10-8-9(15-7-6-13)4-5-11(10)14/h4-5,8,13-14H,6-7H2,1-3H3.
What are the key properties of 2-tert-butyl-4-(2-hydroxyethoxy)phenol?
2-tert-butyl-4-(2-hydroxyethoxy)phenol has a molecular weight of 210.27 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-4-(2-hydroxyethoxy)phenol is sourced from PubChem (CID 18353567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).