bis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane

C24H36Si — CID 21261176

IUPACbis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane
SMILESCCC1CC2C=CC=CC2C1[Si](C)(C)C1C(CC)CC2C=CC=CC21
InChIInChI=1S/C24H36Si/c1-5-17-15-19-11-7-9-13-21(19)23(17)25(3,4)24-18(6-2)16-20-12-8-10-14-22(20)24/h7-14,17-24H,5-6,15-16H2,1-4H3
InChIKeyBZRDMIWSFGCKEM-UHFFFAOYSA-N
MW352.64 g/mol
LogP7.01
Rot. Bonds4

About bis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane

bis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane (PubChem CID 21261176) has the molecular formula C24H36Si and a molecular weight of 352.64 g/mol. Its IUPAC name is bis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane.

Molecular Properties

Compound Namebis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane
PubChem CID21261176
Molecular FormulaC24H36Si
Molecular Weight352.64 g/mol
Exact Mass352.26
IUPAC Namebis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane
SMILESCCC1CC2C=CC=CC2C1[Si](C)(C)C1C(CC)CC2C=CC=CC21
InChIInChI=1S/C24H36Si/c1-5-17-15-19-11-7-9-13-21(19)23(17)25(3,4)24-18(6-2)16-20-12-8-10-14-22(20)24/h7-14,17-24H,5-6,15-16H2,1-4H3
InChIKeyBZRDMIWSFGCKEM-UHFFFAOYSA-N
XLogP7.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.64
LogP ≤ 57.01
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 bis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane?
The IUPAC name of bis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane (CID 21261176) is bis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane.
What is the SMILES notation for bis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane?
The canonical SMILES for bis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane is CCC1CC2C=CC=CC2C1[Si](C)(C)C1C(CC)CC2C=CC=CC21.
What is the InChIKey of bis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane?
The InChIKey is BZRDMIWSFGCKEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H36Si/c1-5-17-15-19-11-7-9-13-21(19)23(17)25(3,4)24-18(6-2)16-20-12-8-10-14-22(20)24/h7-14,17-24H,5-6,15-16H2,1-4H3.
What are the key properties of bis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane?
bis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane has a molecular weight of 352.64 g/mol, XLogP of 7.01, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-ethyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane is sourced from PubChem (CID 21261176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).