2-(1-cyclopropyl-1-hydroxyethyl)phenol

C11H14O2 — CID 115015171

IUPAC2-(1-cyclopropyl-1-hydroxyethyl)phenol
SMILESCC(O)(c1ccccc1O)C1CC1
InChIInChI=1S/C11H14O2/c1-11(13,8-6-7-8)9-4-2-3-5-10(9)12/h2-5,8,12-13H,6-7H2,1H3
InChIKeyHQTFYRYMLZCWML-UHFFFAOYSA-N
MW178.23 g/mol
LogP2.01
Rot. Bonds2

About 2-(1-cyclopropyl-1-hydroxyethyl)phenol

2-(1-cyclopropyl-1-hydroxyethyl)phenol (PubChem CID 115015171) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is 2-(1-cyclopropyl-1-hydroxyethyl)phenol.

Molecular Properties

Compound Name2-(1-cyclopropyl-1-hydroxyethyl)phenol
PubChem CID115015171
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name2-(1-cyclopropyl-1-hydroxyethyl)phenol
SMILESCC(O)(c1ccccc1O)C1CC1
InChIInChI=1S/C11H14O2/c1-11(13,8-6-7-8)9-4-2-3-5-10(9)12/h2-5,8,12-13H,6-7H2,1H3
InChIKeyHQTFYRYMLZCWML-UHFFFAOYSA-N
XLogP2.01
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopropyl-1-hydroxyethyl)phenol?
The IUPAC name of 2-(1-cyclopropyl-1-hydroxyethyl)phenol (CID 115015171) is 2-(1-cyclopropyl-1-hydroxyethyl)phenol.
What is the SMILES notation for 2-(1-cyclopropyl-1-hydroxyethyl)phenol?
The canonical SMILES for 2-(1-cyclopropyl-1-hydroxyethyl)phenol is CC(O)(c1ccccc1O)C1CC1.
What is the InChIKey of 2-(1-cyclopropyl-1-hydroxyethyl)phenol?
The InChIKey is HQTFYRYMLZCWML-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2/c1-11(13,8-6-7-8)9-4-2-3-5-10(9)12/h2-5,8,12-13H,6-7H2,1H3.
What are the key properties of 2-(1-cyclopropyl-1-hydroxyethyl)phenol?
2-(1-cyclopropyl-1-hydroxyethyl)phenol has a molecular weight of 178.23 g/mol, XLogP of 2.01, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopropyl-1-hydroxyethyl)phenol is sourced from PubChem (CID 115015171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).