2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol

C11H16O4 — CID 139797700

IUPAC2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol
SMILESCc1cccc(OCCO)c1OCCO
InChIInChI=1S/C11H16O4/c1-9-3-2-4-10(14-7-5-12)11(9)15-8-6-13/h2-4,12-13H,5-8H2,1H3
InChIKeyFOOWTSBMYUANNV-UHFFFAOYSA-N
MW212.24 g/mol
LogP0.74
Rot. Bonds6

About 2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol

2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol (PubChem CID 139797700) has the molecular formula C11H16O4 and a molecular weight of 212.24 g/mol. Its IUPAC name is 2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol.

Molecular Properties

Compound Name2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol
PubChem CID139797700
Molecular FormulaC11H16O4
Molecular Weight212.24 g/mol
Exact Mass212.10
IUPAC Name2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol
SMILESCc1cccc(OCCO)c1OCCO
InChIInChI=1S/C11H16O4/c1-9-3-2-4-10(14-7-5-12)11(9)15-8-6-13/h2-4,12-13H,5-8H2,1H3
InChIKeyFOOWTSBMYUANNV-UHFFFAOYSA-N
XLogP0.74
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.24
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2,3-bis(4-hydroxybutoxy)phenoxy]butan-1-ol
CID 135239341
6-(2,6-dimethylphenoxy)hexan-1-ol
CID 103801792
2-(2-hydroxyethoxy)-3,6-dimethylphenol
CID 130131096
2-[4-(2-hydroxyethoxy)-2,3-dimethylphenoxy]ethanol
CID 14025005
11-[2-(3-carboxypropoxy)-6-methylphenoxy]undecanoic acid
CID 18796148
13-[2-(3-carboxypropoxy)-3-methylphenoxy]tridecanoic acid
CID 18795889
2-[2-[1-[2-(2-hydroxyethoxy)-3-methylphenyl]propyl]-6-methylphenoxy]ethanol
CID 174987641
11-(2-methylphenoxy)undecan-1-ol
CID 123672662
ethyl 2-(2-hydroxyethoxy)-6-methylbenzoate
CID 10585223
3-(4-methylnaphthalen-1-yl)oxypropan-1-ol
CID 15349996
2-[4-amino-2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol
CID 146405993
1-[2-(2-hydroxypropoxy)-3-methylphenoxy]propan-2-ol
CID 139797710

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol?
The IUPAC name of 2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol (CID 139797700) is 2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol.
What is the SMILES notation for 2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol?
The canonical SMILES for 2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol is Cc1cccc(OCCO)c1OCCO.
What is the InChIKey of 2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol?
The InChIKey is FOOWTSBMYUANNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O4/c1-9-3-2-4-10(14-7-5-12)11(9)15-8-6-13/h2-4,12-13H,5-8H2,1H3.
What are the key properties of 2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol?
2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol has a molecular weight of 212.24 g/mol, XLogP of 0.74, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol is sourced from PubChem (CID 139797700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).