2-methylselanyl-1H-indene

C10H10Se — CID 11041997

IUPAC2-methylselanyl-1H-indene
SMILESC[Se]C1=Cc2ccccc2C1
InChIInChI=1S/C10H10Se/c1-11-10-6-8-4-2-3-5-9(8)7-10/h2-6H,7H2,1H3
InChIKeyDGXDDJSIPCIIOF-UHFFFAOYSA-N
MW209.15 g/mol
LogP2.34
Rot. Bonds1

About 2-methylselanyl-1H-indene

2-methylselanyl-1H-indene (PubChem CID 11041997) has the molecular formula C10H10Se and a molecular weight of 209.15 g/mol. Its IUPAC name is 2-methylselanyl-1H-indene.

Molecular Properties

Compound Name2-methylselanyl-1H-indene
PubChem CID11041997
Molecular FormulaC10H10Se
Molecular Weight209.15 g/mol
Exact Mass209.99
IUPAC Name2-methylselanyl-1H-indene
SMILESC[Se]C1=Cc2ccccc2C1
InChIInChI=1S/C10H10Se/c1-11-10-6-8-4-2-3-5-9(8)7-10/h2-6H,7H2,1H3
InChIKeyDGXDDJSIPCIIOF-UHFFFAOYSA-N
XLogP2.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.15
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methylselanyl-1H-indene?
The IUPAC name of 2-methylselanyl-1H-indene (CID 11041997) is 2-methylselanyl-1H-indene.
What is the SMILES notation for 2-methylselanyl-1H-indene?
The canonical SMILES for 2-methylselanyl-1H-indene is C[Se]C1=Cc2ccccc2C1.
What is the InChIKey of 2-methylselanyl-1H-indene?
The InChIKey is DGXDDJSIPCIIOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Se/c1-11-10-6-8-4-2-3-5-9(8)7-10/h2-6H,7H2,1H3.
What are the key properties of 2-methylselanyl-1H-indene?
2-methylselanyl-1H-indene has a molecular weight of 209.15 g/mol, XLogP of 2.34, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylselanyl-1H-indene is sourced from PubChem (CID 11041997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).