2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol

C9H18O3 — CID 130124161

IUPAC2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol
SMILESCC(C)CC1(CCO)OCCO1
InChIInChI=1S/C9H18O3/c1-8(2)7-9(3-4-10)11-5-6-12-9/h8,10H,3-7H2,1-2H3
InChIKeyMOOMZCUTQHPKDW-UHFFFAOYSA-N
MW174.24 g/mol
LogP1.16
Rot. Bonds4

About 2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol

2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol (PubChem CID 130124161) has the molecular formula C9H18O3 and a molecular weight of 174.24 g/mol. Its IUPAC name is 2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol.

Molecular Properties

Compound Name2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol
PubChem CID130124161
Molecular FormulaC9H18O3
Molecular Weight174.24 g/mol
Exact Mass174.13
IUPAC Name2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol
SMILESCC(C)CC1(CCO)OCCO1
InChIInChI=1S/C9H18O3/c1-8(2)7-9(3-4-10)11-5-6-12-9/h8,10H,3-7H2,1-2H3
InChIKeyMOOMZCUTQHPKDW-UHFFFAOYSA-N
XLogP1.16
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-hexyl-2-(2-methylpropyl)-1,3-dioxane
CID 89440656
2-[(2R,3S)-3-(1,3-dioxolan-2-ylmethyl)-5-iodo-2-methylpentyl]-2-(2-methylpropyl)-1,3-dioxolane
CID 10895187
1,1-dideuterio-2-[2-(2,2-dideuterio-2-hydroxyethyl)-1,3-dioxolan-2-yl]ethanol
CID 118056005
7-(2-decyl-1,3-dioxolan-2-yl)heptan-1-ol
CID 10359175
2-(2-ethyloxolan-2-yl)ethanol
CID 142632895
2-[(2-methyl-1,3-dioxolan-2-yl)methyl]propane-1,3-diol
CID 86098194
6-(2-ethyloxetan-2-yl)hexan-1-ol
CID 68634810
2-[1-(2-propyl-1,3-dioxolan-2-yl)cyclopropyl]ethanol
CID 22042453
3-(2-methyl-1,3-dioxolan-2-yl)propane-1,2-diol
CID 71381727
2,2-bis(2-methylpropyl)-1,3-dioxane-4,6-dione
CID 23303482
2,2-bis(2-methylpropyl)oxane
CID 57237158
[4-ethyl-2-methyl-2-(2-methylpropyl)-1,3-oxazolidin-4-yl]methanol
CID 19920835

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol?
The IUPAC name of 2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol (CID 130124161) is 2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol.
What is the SMILES notation for 2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol?
The canonical SMILES for 2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol is CC(C)CC1(CCO)OCCO1.
What is the InChIKey of 2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol?
The InChIKey is MOOMZCUTQHPKDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O3/c1-8(2)7-9(3-4-10)11-5-6-12-9/h8,10H,3-7H2,1-2H3.
What are the key properties of 2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol?
2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol has a molecular weight of 174.24 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methylpropyl)-1,3-dioxolan-2-yl]ethanol is sourced from PubChem (CID 130124161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).