4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol

C18H18O2 — CID 140933699

IUPAC4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol
SMILESOC1CCc2c(-c3cccc4c3CCC4O)cccc21
InChIInChI=1S/C18H18O2/c19-17-9-7-13-11(3-1-5-15(13)17)12-4-2-6-16-14(12)8-10-18(16)20/h1-6,17-20H,7-10H2
InChIKeyPRZYQZDRUFOWJL-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.31
Rot. Bonds1

About 4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol

4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol (PubChem CID 140933699) has the molecular formula C18H18O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is 4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol
PubChem CID140933699
Molecular FormulaC18H18O2
Molecular Weight266.34 g/mol
Exact Mass266.13
IUPAC Name4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol
SMILESOC1CCc2c(-c3cccc4c3CCC4O)cccc21
InChIInChI=1S/C18H18O2/c19-17-9-7-13-11(3-1-5-15(13)17)12-4-2-6-16-14(12)8-10-18(16)20/h1-6,17-20H,7-10H2
InChIKeyPRZYQZDRUFOWJL-UHFFFAOYSA-N
XLogP3.31
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol (CID 140933699) is 4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol is OC1CCc2c(-c3cccc4c3CCC4O)cccc21.
What is the InChIKey of 4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol?
The InChIKey is PRZYQZDRUFOWJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18O2/c19-17-9-7-13-11(3-1-5-15(13)17)12-4-2-6-16-14(12)8-10-18(16)20/h1-6,17-20H,7-10H2.
What are the key properties of 4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol?
4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol has a molecular weight of 266.34 g/mol, XLogP of 3.31, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-hydroxy-2,3-dihydro-1H-inden-4-yl)-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 140933699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).