2-(3,4-dihydro-2H-chromen-2-yl)ethanol

C11H14O2 — CID 22420297

IUPAC2-(3,4-dihydro-2H-chromen-2-yl)ethanol
SMILESOCCC1CCc2ccccc2O1
InChIInChI=1S/C11H14O2/c12-8-7-10-6-5-9-3-1-2-4-11(9)13-10/h1-4,10,12H,5-8H2
InChIKeyVIDWVCCCBOXZME-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.76
Rot. Bonds2

About 2-(3,4-dihydro-2H-chromen-2-yl)ethanol

2-(3,4-dihydro-2H-chromen-2-yl)ethanol (PubChem CID 22420297) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is 2-(3,4-dihydro-2H-chromen-2-yl)ethanol.

Molecular Properties

Compound Name2-(3,4-dihydro-2H-chromen-2-yl)ethanol
PubChem CID22420297
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name2-(3,4-dihydro-2H-chromen-2-yl)ethanol
SMILESOCCC1CCc2ccccc2O1
InChIInChI=1S/C11H14O2/c12-8-7-10-6-5-9-3-1-2-4-11(9)13-10/h1-4,10,12H,5-8H2
InChIKeyVIDWVCCCBOXZME-UHFFFAOYSA-N
XLogP1.76
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dihydro-2H-chromen-2-yl)ethanol?
The IUPAC name of 2-(3,4-dihydro-2H-chromen-2-yl)ethanol (CID 22420297) is 2-(3,4-dihydro-2H-chromen-2-yl)ethanol.
What is the SMILES notation for 2-(3,4-dihydro-2H-chromen-2-yl)ethanol?
The canonical SMILES for 2-(3,4-dihydro-2H-chromen-2-yl)ethanol is OCCC1CCc2ccccc2O1.
What is the InChIKey of 2-(3,4-dihydro-2H-chromen-2-yl)ethanol?
The InChIKey is VIDWVCCCBOXZME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2/c12-8-7-10-6-5-9-3-1-2-4-11(9)13-10/h1-4,10,12H,5-8H2.
What are the key properties of 2-(3,4-dihydro-2H-chromen-2-yl)ethanol?
2-(3,4-dihydro-2H-chromen-2-yl)ethanol has a molecular weight of 178.23 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dihydro-2H-chromen-2-yl)ethanol is sourced from PubChem (CID 22420297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).