3,3'-spirobi[1,2-dihydroindene]-4-ol

C17H16O — CID 162403250

IUPAC3,3'-spirobi[1,2-dihydroindene]-4-ol
SMILESOc1cccc2c1C1(CCc3ccccc31)CC2
InChIInChI=1S/C17H16O/c18-15-7-3-5-13-9-11-17(16(13)15)10-8-12-4-1-2-6-14(12)17/h1-7,18H,8-11H2
InChIKeyJFYBYWHQWQTSIH-UHFFFAOYSA-N
MW236.31 g/mol
LogP3.57
Rot. Bonds

About 3,3'-spirobi[1,2-dihydroindene]-4-ol

3,3'-spirobi[1,2-dihydroindene]-4-ol (PubChem CID 162403250) has the molecular formula C17H16O and a molecular weight of 236.31 g/mol. Its IUPAC name is 3,3'-spirobi[1,2-dihydroindene]-4-ol.

Molecular Properties

Compound Name3,3'-spirobi[1,2-dihydroindene]-4-ol
PubChem CID162403250
Molecular FormulaC17H16O
Molecular Weight236.31 g/mol
Exact Mass236.12
IUPAC Name3,3'-spirobi[1,2-dihydroindene]-4-ol
SMILESOc1cccc2c1C1(CCc3ccccc31)CC2
InChIInChI=1S/C17H16O/c18-15-7-3-5-13-9-11-17(16(13)15)10-8-12-4-1-2-6-14(12)17/h1-7,18H,8-11H2
InChIKeyJFYBYWHQWQTSIH-UHFFFAOYSA-N
XLogP3.57
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3S)-1'-diphenylphosphanylspiro[1,2-dihydroindene-3,5'-cyclopentene]-4-ol
CID 122221437
1-methyl-2,3-dihydroindene-1,7-diol
CID 175232410
spiro[cyclohexane-4,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene]-1-ol
CID 71263398
spiro[cyclohexene-4,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene]
CID 123687681
spiro[1,2-dihydroindene-3,7'-5,6-dihydrocyclopenta[b]pyridine]
CID 59325833
5,5'-diphenyl-3,3'-spirobi[1,2-dihydroindene]-4,4'-diol
CID 50917365
spiro[1,2-dihydroindene-3,3'-pyrrolidine]-2'-one
CID 105442633
spiro[piperidine-5,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene]-2-one
CID 24846104
(3S)-spiro[1,2-dihydroindene-3,3'-oxolane]-2',5'-dione
CID 129374458
1'-methylspiro[1,2-dihydroindene-3,3'-2H-indole]
CID 11322294
1-fluoro-1-methyl-2,3-dihydroinden-4-ol
CID 84652361
(1S)-1-methyl-2,3-dihydroindene-1-carboxylic acid
CID 124509477

Frequently Asked Questions

What is the IUPAC name of 3,3'-spirobi[1,2-dihydroindene]-4-ol?
The IUPAC name of 3,3'-spirobi[1,2-dihydroindene]-4-ol (CID 162403250) is 3,3'-spirobi[1,2-dihydroindene]-4-ol.
What is the SMILES notation for 3,3'-spirobi[1,2-dihydroindene]-4-ol?
The canonical SMILES for 3,3'-spirobi[1,2-dihydroindene]-4-ol is Oc1cccc2c1C1(CCc3ccccc31)CC2.
What is the InChIKey of 3,3'-spirobi[1,2-dihydroindene]-4-ol?
The InChIKey is JFYBYWHQWQTSIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16O/c18-15-7-3-5-13-9-11-17(16(13)15)10-8-12-4-1-2-6-14(12)17/h1-7,18H,8-11H2.
What are the key properties of 3,3'-spirobi[1,2-dihydroindene]-4-ol?
3,3'-spirobi[1,2-dihydroindene]-4-ol has a molecular weight of 236.31 g/mol, XLogP of 3.57, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3'-spirobi[1,2-dihydroindene]-4-ol is sourced from PubChem (CID 162403250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).