[2-ethoxy-3-(hydroxymethyl)phenyl]methanol

C10H14O3 — CID 118269330

IUPAC[2-ethoxy-3-(hydroxymethyl)phenyl]methanol
SMILESCCOc1c(CO)cccc1CO
InChIInChI=1S/C10H14O3/c1-2-13-10-8(6-11)4-3-5-9(10)7-12/h3-5,11-12H,2,6-7H2,1H3
InChIKeyMMAPAZNCNLOUNI-UHFFFAOYSA-N
MW182.22 g/mol
LogP1.07
Rot. Bonds4

About [2-ethoxy-3-(hydroxymethyl)phenyl]methanol

[2-ethoxy-3-(hydroxymethyl)phenyl]methanol (PubChem CID 118269330) has the molecular formula C10H14O3 and a molecular weight of 182.22 g/mol. Its IUPAC name is [2-ethoxy-3-(hydroxymethyl)phenyl]methanol.

Molecular Properties

Compound Name[2-ethoxy-3-(hydroxymethyl)phenyl]methanol
PubChem CID118269330
Molecular FormulaC10H14O3
Molecular Weight182.22 g/mol
Exact Mass182.09
IUPAC Name[2-ethoxy-3-(hydroxymethyl)phenyl]methanol
SMILESCCOc1c(CO)cccc1CO
InChIInChI=1S/C10H14O3/c1-2-13-10-8(6-11)4-3-5-9(10)7-12/h3-5,11-12H,2,6-7H2,1H3
InChIKeyMMAPAZNCNLOUNI-UHFFFAOYSA-N
XLogP1.07
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-ethoxy-3-(hydroxymethyl)phenyl]methanol?
The IUPAC name of [2-ethoxy-3-(hydroxymethyl)phenyl]methanol (CID 118269330) is [2-ethoxy-3-(hydroxymethyl)phenyl]methanol.
What is the SMILES notation for [2-ethoxy-3-(hydroxymethyl)phenyl]methanol?
The canonical SMILES for [2-ethoxy-3-(hydroxymethyl)phenyl]methanol is CCOc1c(CO)cccc1CO.
What is the InChIKey of [2-ethoxy-3-(hydroxymethyl)phenyl]methanol?
The InChIKey is MMAPAZNCNLOUNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O3/c1-2-13-10-8(6-11)4-3-5-9(10)7-12/h3-5,11-12H,2,6-7H2,1H3.
What are the key properties of [2-ethoxy-3-(hydroxymethyl)phenyl]methanol?
[2-ethoxy-3-(hydroxymethyl)phenyl]methanol has a molecular weight of 182.22 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethoxy-3-(hydroxymethyl)phenyl]methanol is sourced from PubChem (CID 118269330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).