3H-inden-5-ol

C9H8O — CID 21274580

IUPAC3H-inden-5-ol
SMILESOc1ccc2c(c1)CC=C2
InChIInChI=1S/C9H8O/c10-9-5-4-7-2-1-3-8(7)6-9/h1-2,4-6,10H,3H2
InChIKeyPODHIIGQVAJGOK-UHFFFAOYSA-N
MW132.16 g/mol
LogP1.96
Rot. Bonds

About 3H-inden-5-ol

3H-inden-5-ol (PubChem CID 21274580) has the molecular formula C9H8O and a molecular weight of 132.16 g/mol. Its IUPAC name is 3H-inden-5-ol.

Molecular Properties

Compound Name3H-inden-5-ol
PubChem CID21274580
Molecular FormulaC9H8O
Molecular Weight132.16 g/mol
Exact Mass132.06
IUPAC Name3H-inden-5-ol
SMILESOc1ccc2c(c1)CC=C2
InChIInChI=1S/C9H8O/c10-9-5-4-7-2-1-3-8(7)6-9/h1-2,4-6,10H,3H2
InChIKeyPODHIIGQVAJGOK-UHFFFAOYSA-N
XLogP1.96
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.16
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3H-inden-5-ol?
The IUPAC name of 3H-inden-5-ol (CID 21274580) is 3H-inden-5-ol.
What is the SMILES notation for 3H-inden-5-ol?
The canonical SMILES for 3H-inden-5-ol is Oc1ccc2c(c1)CC=C2.
What is the InChIKey of 3H-inden-5-ol?
The InChIKey is PODHIIGQVAJGOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8O/c10-9-5-4-7-2-1-3-8(7)6-9/h1-2,4-6,10H,3H2.
What are the key properties of 3H-inden-5-ol?
3H-inden-5-ol has a molecular weight of 132.16 g/mol, XLogP of 1.96, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3H-inden-5-ol is sourced from PubChem (CID 21274580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).