2-benzyl-2,3-dihydro-1H-inden-1-ol

C16H16O — CID 562615

IUPAC2-benzyl-2,3-dihydro-1H-inden-1-ol
SMILESOC1c2ccccc2CC1Cc1ccccc1
InChIInChI=1S/C16H16O/c17-16-14(10-12-6-2-1-3-7-12)11-13-8-4-5-9-15(13)16/h1-9,14,16-17H,10-11H2
InChIKeyJEBQRQRDSPRILJ-UHFFFAOYSA-N
MW224.30 g/mol
LogP3.13
Rot. Bonds2

About 2-benzyl-2,3-dihydro-1H-inden-1-ol

2-benzyl-2,3-dihydro-1H-inden-1-ol (PubChem CID 562615) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is 2-benzyl-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name2-benzyl-2,3-dihydro-1H-inden-1-ol
PubChem CID562615
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name2-benzyl-2,3-dihydro-1H-inden-1-ol
SMILESOC1c2ccccc2CC1Cc1ccccc1
InChIInChI=1S/C16H16O/c17-16-14(10-12-6-2-1-3-7-12)11-13-8-4-5-9-15(13)16/h1-9,14,16-17H,10-11H2
InChIKeyJEBQRQRDSPRILJ-UHFFFAOYSA-N
XLogP3.13
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-benzyl-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 2-benzyl-2,3-dihydro-1H-inden-1-ol (CID 562615) is 2-benzyl-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 2-benzyl-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 2-benzyl-2,3-dihydro-1H-inden-1-ol is OC1c2ccccc2CC1Cc1ccccc1.
What is the InChIKey of 2-benzyl-2,3-dihydro-1H-inden-1-ol?
The InChIKey is JEBQRQRDSPRILJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O/c17-16-14(10-12-6-2-1-3-7-12)11-13-8-4-5-9-15(13)16/h1-9,14,16-17H,10-11H2.
What are the key properties of 2-benzyl-2,3-dihydro-1H-inden-1-ol?
2-benzyl-2,3-dihydro-1H-inden-1-ol has a molecular weight of 224.30 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 562615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).