spiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol

C12H14O3 — CID 10584398

IUPACspiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol
SMILESOCC1CC2(OCCO2)c2ccccc21
InChIInChI=1S/C12H14O3/c13-8-9-7-12(14-5-6-15-12)11-4-2-1-3-10(9)11/h1-4,9,13H,5-8H2
InChIKeyCEQGRTQHSQDHGT-UHFFFAOYSA-N
MW206.24 g/mol
LogP1.37
Rot. Bonds1

About spiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol

spiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol (PubChem CID 10584398) has the molecular formula C12H14O3 and a molecular weight of 206.24 g/mol. Its IUPAC name is spiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol.

Molecular Properties

Compound Namespiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol
PubChem CID10584398
Molecular FormulaC12H14O3
Molecular Weight206.24 g/mol
Exact Mass206.09
IUPAC Namespiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol
SMILESOCC1CC2(OCCO2)c2ccccc21
InChIInChI=1S/C12H14O3/c13-8-9-7-12(14-5-6-15-12)11-4-2-1-3-10(9)11/h1-4,9,13H,5-8H2
InChIKeyCEQGRTQHSQDHGT-UHFFFAOYSA-N
XLogP1.37
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of spiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol?
The IUPAC name of spiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol (CID 10584398) is spiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol.
What is the SMILES notation for spiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol?
The canonical SMILES for spiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol is OCC1CC2(OCCO2)c2ccccc21.
What is the InChIKey of spiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol?
The InChIKey is CEQGRTQHSQDHGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O3/c13-8-9-7-12(14-5-6-15-12)11-4-2-1-3-10(9)11/h1-4,9,13H,5-8H2.
What are the key properties of spiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol?
spiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol has a molecular weight of 206.24 g/mol, XLogP of 1.37, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1,2-dihydroindene-3,2'-1,3-dioxolane]-1-ylmethanol is sourced from PubChem (CID 10584398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).