(1S)-1-ethyl-2,3-dihydroinden-1-ol

C11H14O — CID 92951732

IUPAC(1S)-1-ethyl-2,3-dihydroinden-1-ol
SMILESCC[C@]1(O)CCc2ccccc21
InChIInChI=1S/C11H14O/c1-2-11(12)8-7-9-5-3-4-6-10(9)11/h3-6,12H,2,7-8H2,1H3/t11-/m0/s1
InChIKeyORIMZVQZPYTJKI-NSHDSACASA-N
MW162.23 g/mol
LogP2.23
Rot. Bonds1

About (1S)-1-ethyl-2,3-dihydroinden-1-ol

(1S)-1-ethyl-2,3-dihydroinden-1-ol (PubChem CID 92951732) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is (1S)-1-ethyl-2,3-dihydroinden-1-ol.

Molecular Properties

Compound Name(1S)-1-ethyl-2,3-dihydroinden-1-ol
PubChem CID92951732
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name(1S)-1-ethyl-2,3-dihydroinden-1-ol
SMILESCC[C@]1(O)CCc2ccccc21
InChIInChI=1S/C11H14O/c1-2-11(12)8-7-9-5-3-4-6-10(9)11/h3-6,12H,2,7-8H2,1H3/t11-/m0/s1
InChIKeyORIMZVQZPYTJKI-NSHDSACASA-N
XLogP2.23
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1S)-1-ethyl-2,3-dihydroinden-1-ol?
The IUPAC name of (1S)-1-ethyl-2,3-dihydroinden-1-ol (CID 92951732) is (1S)-1-ethyl-2,3-dihydroinden-1-ol.
What is the SMILES notation for (1S)-1-ethyl-2,3-dihydroinden-1-ol?
The canonical SMILES for (1S)-1-ethyl-2,3-dihydroinden-1-ol is CC[C@]1(O)CCc2ccccc21.
What is the InChIKey of (1S)-1-ethyl-2,3-dihydroinden-1-ol?
The InChIKey is ORIMZVQZPYTJKI-NSHDSACASA-N. The full InChI is InChI=1S/C11H14O/c1-2-11(12)8-7-9-5-3-4-6-10(9)11/h3-6,12H,2,7-8H2,1H3/t11-/m0/s1.
What are the key properties of (1S)-1-ethyl-2,3-dihydroinden-1-ol?
(1S)-1-ethyl-2,3-dihydroinden-1-ol has a molecular weight of 162.23 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-ethyl-2,3-dihydroinden-1-ol is sourced from PubChem (CID 92951732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).