1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol

C11H14O3 — CID 84665384

IUPAC1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol
SMILESCC(O)c1ccc(C2COCO2)cc1
InChIInChI=1S/C11H14O3/c1-8(12)9-2-4-10(5-3-9)11-6-13-7-14-11/h2-5,8,11-12H,6-7H2,1H3
InChIKeyIZECDXOPHYFADQ-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.79
Rot. Bonds2

About 1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol

1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol (PubChem CID 84665384) has the molecular formula C11H14O3 and a molecular weight of 194.23 g/mol. Its IUPAC name is 1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol.

Molecular Properties

Compound Name1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol
PubChem CID84665384
Molecular FormulaC11H14O3
Molecular Weight194.23 g/mol
Exact Mass194.09
IUPAC Name1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol
SMILESCC(O)c1ccc(C2COCO2)cc1
InChIInChI=1S/C11H14O3/c1-8(12)9-2-4-10(5-3-9)11-6-13-7-14-11/h2-5,8,11-12H,6-7H2,1H3
InChIKeyIZECDXOPHYFADQ-UHFFFAOYSA-N
XLogP1.79
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(1,3-dioxolan-4-yl)phenyl]-2-hydroxyacetic acid
CID 117321357
1-[4-(1-methylpiperidin-4-yl)phenyl]ethanol
CID 58103926
1-[4-[2,3-difluoro-4-[4-[2-[2-fluoro-4-(oxiran-2-yl)phenyl]ethyl]phenyl]phenyl]phenyl]ethanol
CID 89124581
3-[4-(1,3-dioxolan-4-yl)phenyl]-1-methylpyrazol-5-amine
CID 117365167
1-[2-[4-(1,3-dioxolan-4-yl)phenyl]ethyl]cyclopropan-1-amine
CID 105493076
2-[4-(2-methylpropylsulfanyl)phenyl]oxirane
CID 13456629
2-amino-1-[4-(oxetan-3-yl)phenyl]propan-1-ol
CID 112710041
(2R)-2-(4-propan-2-yloxyphenyl)oxirane
CID 30071232
(1R)-1-[4-(3-ethylmorpholin-4-yl)phenyl]ethanol
CID 78939798
N-[3-(cyclopentylmethyl)-5-[4-(1-hydroxyethyl)phenyl]pyrazin-2-yl]-2-[4-(oxiran-2-yl)phenyl]acetamide
CID 88905243
bis(2-phenyloxirane);2-phenylpropan-1-ol
CID 161299790
1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol
CID 154574830

Frequently Asked Questions

What is the IUPAC name of 1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol?
The IUPAC name of 1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol (CID 84665384) is 1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol.
What is the SMILES notation for 1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol?
The canonical SMILES for 1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol is CC(O)c1ccc(C2COCO2)cc1.
What is the InChIKey of 1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol?
The InChIKey is IZECDXOPHYFADQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O3/c1-8(12)9-2-4-10(5-3-9)11-6-13-7-14-11/h2-5,8,11-12H,6-7H2,1H3.
What are the key properties of 1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol?
1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol has a molecular weight of 194.23 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1,3-dioxolan-4-yl)phenyl]ethanol is sourced from PubChem (CID 84665384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).