2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol

C12H18O3 — CID 117300551

IUPAC2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol
SMILESCC(C)(CO)c1ccc(OCCO)cc1
InChIInChI=1S/C12H18O3/c1-12(2,9-14)10-3-5-11(6-4-10)15-8-7-13/h3-6,13-14H,7-9H2,1-2H3
InChIKeyMAJFNHTYBSDOIP-UHFFFAOYSA-N
MW210.27 g/mol
LogP1.33
Rot. Bonds5

About 2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol

2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol (PubChem CID 117300551) has the molecular formula C12H18O3 and a molecular weight of 210.27 g/mol. Its IUPAC name is 2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol
PubChem CID117300551
Molecular FormulaC12H18O3
Molecular Weight210.27 g/mol
Exact Mass210.13
IUPAC Name2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol
SMILESCC(C)(CO)c1ccc(OCCO)cc1
InChIInChI=1S/C12H18O3/c1-12(2,9-14)10-3-5-11(6-4-10)15-8-7-13/h3-6,13-14H,7-9H2,1-2H3
InChIKeyMAJFNHTYBSDOIP-UHFFFAOYSA-N
XLogP1.33
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.27
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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2-[4-(2-methyloctan-2-yl)phenoxy]ethanol
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2-methyl-2-[4-(2-methylpropoxy)phenyl]propan-1-ol
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2-[2-[2-[2-[2-[4-(2-methylbutan-2-yl)phenoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
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2-[2-[4-[2-[4-(2-hydroxyethoxy)phenyl]propan-2-yl]phenoxy]ethoxy]ethanol
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CID 162335780
CID 162335780
acetic acid;2-(4-ethoxyphenyl)-2-methylpropan-1-ol
CID 175113858
2-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(2-hydroxyethoxy)phenyl]propan-2-yl]phenoxy]ethanol
CID 14533806
1-[4-(2-hydroxyethoxy)phenyl]-1-(4-methoxyphenyl)prop-2-en-1-ol
CID 147108243
2-[4-[2-[4-(2-hydroxyethoxy)phenyl]-5-methylhexan-2-yl]phenoxy]ethanol
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2-[4-[2-[4-(1-hydroxy-2-methylpropan-2-yl)phenyl]propan-2-yl]phenyl]-2-methylpropan-1-ol
CID 14440449
2-[2-[2-[2-[2-[2-[2-[4-(2-methylheptan-2-yl)phenoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 90471302

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol?
The IUPAC name of 2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol (CID 117300551) is 2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol.
What is the SMILES notation for 2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol?
The canonical SMILES for 2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol is CC(C)(CO)c1ccc(OCCO)cc1.
What is the InChIKey of 2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol?
The InChIKey is MAJFNHTYBSDOIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O3/c1-12(2,9-14)10-3-5-11(6-4-10)15-8-7-13/h3-6,13-14H,7-9H2,1-2H3.
What are the key properties of 2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol?
2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol has a molecular weight of 210.27 g/mol, XLogP of 1.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-hydroxyethoxy)phenyl]-2-methylpropan-1-ol is sourced from PubChem (CID 117300551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).