2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol

C21H24O2 — CID 54557003

IUPAC2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol
SMILESCc1cc2c(cc1O)CC(C)C21c2cc(O)c(C)cc2CC1C
InChIInChI=1S/C21H24O2/c1-11-5-15-7-13(3)21(18(15)10-20(11)23)14(4)8-16-9-19(22)12(2)6-17(16)21/h5-6,9-10,13-14,22-23H,7-8H2,1-4H3
InChIKeyZNWINWXGZHQTIV-UHFFFAOYSA-N
MW308.42 g/mol
LogP4.39
Rot. Bonds

About 2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol

2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol (PubChem CID 54557003) has the molecular formula C21H24O2 and a molecular weight of 308.42 g/mol. Its IUPAC name is 2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol.

Molecular Properties

Compound Name2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol
PubChem CID54557003
Molecular FormulaC21H24O2
Molecular Weight308.42 g/mol
Exact Mass308.18
IUPAC Name2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol
SMILESCc1cc2c(cc1O)CC(C)C21c2cc(O)c(C)cc2CC1C
InChIInChI=1S/C21H24O2/c1-11-5-15-7-13(3)21(18(15)10-20(11)23)14(4)8-16-9-19(22)12(2)6-17(16)21/h5-6,9-10,13-14,22-23H,7-8H2,1-4H3
InChIKeyZNWINWXGZHQTIV-UHFFFAOYSA-N
XLogP4.39
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.42
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol?
The IUPAC name of 2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol (CID 54557003) is 2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol.
What is the SMILES notation for 2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol?
The canonical SMILES for 2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol is Cc1cc2c(cc1O)CC(C)C21c2cc(O)c(C)cc2CC1C.
What is the InChIKey of 2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol?
The InChIKey is ZNWINWXGZHQTIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24O2/c1-11-5-15-7-13(3)21(18(15)10-20(11)23)14(4)8-16-9-19(22)12(2)6-17(16)21/h5-6,9-10,13-14,22-23H,7-8H2,1-4H3.
What are the key properties of 2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol?
2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol has a molecular weight of 308.42 g/mol, XLogP of 4.39, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2',6,6'-tetramethylspiro[1,2-dihydroindene-3,1'-2,3-dihydroindene]-5,5'-diol is sourced from PubChem (CID 54557003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).