cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane

C39H78Si2 — CID 158449192

IUPACcyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane
SMILESCC.CC1=C(C)[C@@H]([Si](C)(C)C2CCCCC2)[C@H](C)[C@@H]1C.CC1=C(C)[C@H]([Si](C)(C)C2CCCCC2)[C@H](C)[C@@H]1C.CCC
InChIInChI=1S/2C17H32Si.C3H8.C2H6/c2*1-12-13(2)15(4)17(14(12)3)18(5,6)16-10-8-7-9-11-16;1-3-2;1-2/h2*12,14,16-17H,7-11H2,1-6H3;3H2,1-2H3;1-2H3/t12-,14-,17+;12-,14-,17-;;/m11../s1
InChIKeyHDTPKYGCTQHYOX-PCPHMPGYSA-N
MW603.23 g/mol
LogP14.49
Rot. Bonds4

About cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane

cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane (PubChem CID 158449192) has the molecular formula C39H78Si2 and a molecular weight of 603.23 g/mol. Its IUPAC name is cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane.

Molecular Properties

Compound Namecyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane
PubChem CID158449192
Molecular FormulaC39H78Si2
Molecular Weight603.23 g/mol
Exact Mass602.56
IUPAC Namecyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane
SMILESCC.CC1=C(C)[C@@H]([Si](C)(C)C2CCCCC2)[C@H](C)[C@@H]1C.CC1=C(C)[C@H]([Si](C)(C)C2CCCCC2)[C@H](C)[C@@H]1C.CCC
InChIInChI=1S/2C17H32Si.C3H8.C2H6/c2*1-12-13(2)15(4)17(14(12)3)18(5,6)16-10-8-7-9-11-16;1-3-2;1-2/h2*12,14,16-17H,7-11H2,1-6H3;3H2,1-2H3;1-2H3/t12-,14-,17+;12-,14-,17-;;/m11../s1
InChIKeyHDTPKYGCTQHYOX-PCPHMPGYSA-N
XLogP14.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500603.23
LogP ≤ 514.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane with MolForge

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Related Compounds

dimethyl-bis(2-methyl-3a,4,5,6,7,7a-hexahydro-3H-inden-1-yl)silane
CID 54417051
cyclohexyl-dimethyl-[(1R,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane
CID 59895391
cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;propane
CID 90989258
cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane
CID 90989259
cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane
CID 91510943
2-(4-Cyclohexylcyclohexyl)-5-(1,1-diethyl-3,4,5-trimethylsilol-2-yl)-1,1-diethyl-3,4-dimethylsilole
CID 140435075
trimethyl-[2-methyl-3-[2-(2-methyl-3-trimethylsilyl-3a,4,5,6,7,7a-hexahydro-3H-inden-1-yl)ethyl]-3a,4,5,6,7,7a-hexahydro-1H-inden-1-yl]silane
CID 140437584
bis[(3aS)-2,3,4,5,6,7-hexamethyl-3a,7a-dihydro-1H-inden-1-yl]-methyl-propylsilane
CID 140769834
bis[(3aS)-2,3,4,5,6,7-hexamethyl-3a,7a-dihydro-1H-inden-1-yl]-dimethylsilane
CID 140769840
bis(barium(2+));carbanide;bis(cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane);propane;propane
CID 159660256
barium(2+);carbanide;cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane
CID 160425408
lithium;chloro-cyclohexyl-dimethylsilane;cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;1,2,3,4-tetramethylcyclopentane;chloride
CID 162283850

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane?
The IUPAC name of cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane (CID 158449192) is cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane.
What is the SMILES notation for cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane?
The canonical SMILES for cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane is CC.CC1=C(C)[C@@H]([Si](C)(C)C2CCCCC2)[C@H](C)[C@@H]1C.CC1=C(C)[C@H]([Si](C)(C)C2CCCCC2)[C@H](C)[C@@H]1C.CCC.
What is the InChIKey of cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane?
The InChIKey is HDTPKYGCTQHYOX-PCPHMPGYSA-N. The full InChI is InChI=1S/2C17H32Si.C3H8.C2H6/c2*1-12-13(2)15(4)17(14(12)3)18(5,6)16-10-8-7-9-11-16;1-3-2;1-2/h2*12,14,16-17H,7-11H2,1-6H3;3H2,1-2H3;1-2H3/t12-,14-,17+;12-,14-,17-;;/m11../s1.
What are the key properties of cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane?
cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane has a molecular weight of 603.23 g/mol, XLogP of 14.49, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-dimethyl-[(1R,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;cyclohexyl-dimethyl-[(1S,4S,5R)-2,3,4,5-tetramethylcyclopent-2-en-1-yl]silane;ethane;propane is sourced from PubChem (CID 158449192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).