trimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane

C17H32Si2 — CID 553398

IUPACtrimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane
SMILESCC1=C(C)C([Si](C)(C)C)=CC(C)(C)C=C1[Si](C)(C)C
InChIInChI=1S/C17H32Si2/c1-13-14(2)16(19(8,9)10)12-17(3,4)11-15(13)18(5,6)7/h11-12H,1-10H3
InChIKeyXKIVZBCIWRTIOY-UHFFFAOYSA-N
MW292.62 g/mol
LogP5.97
Rot. Bonds2

About trimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane

trimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane (PubChem CID 553398) has the molecular formula C17H32Si2 and a molecular weight of 292.62 g/mol. Its IUPAC name is trimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane.

Molecular Properties

Compound Nametrimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane
PubChem CID553398
Molecular FormulaC17H32Si2
Molecular Weight292.62 g/mol
Exact Mass292.20
IUPAC Nametrimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane
SMILESCC1=C(C)C([Si](C)(C)C)=CC(C)(C)C=C1[Si](C)(C)C
InChIInChI=1S/C17H32Si2/c1-13-14(2)16(19(8,9)10)12-17(3,4)11-15(13)18(5,6)7/h11-12H,1-10H3
InChIKeyXKIVZBCIWRTIOY-UHFFFAOYSA-N
XLogP5.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.62
LogP ≤ 55.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2,3,5,5-Tetrakis(trimethylsilyl)-1,3-cyclopentadiene
CID 3335332
[7,10-Dimethyl-1,4,4-tris(trimethylsilyl)-5-silaspiro[4.6]undeca-6,8,10-trien-1-yl]-trimethylsilane
CID 101175020
Lithium [[3,5-bis[bis(trimethylsilyl)methyl]benzene-4-id-1-yl]-trimethylsilylmethyl]-trimethylsilane
CID 11060749
[(4E,6E)-5,6-dimethyl-7-trimethylsilyldeca-1,4,6,9-tetraen-4-yl]-trimethylsilane
CID 11781753
[3,4-Bis[2,2-bis(trimethylsilyl)ethenyl]-1,6,6-tris(trimethylsilyl)hexa-1,3,5-trienyl]-trimethylsilane
CID 134949816
1,3,5-Cycloheptatriene, 2,4,7,7-tetramethyl-2,4-bis(trimethylsilyl)-
CID 552112
1,3,5-Cycloheptatriene, 7,7-dimethyl-2,4-bis(trimethylsilyl)-
CID 553285
1,3,5-Cycloheptatriene, 7,7-dimethyl-3,4-bis(trimethylsilylmethyl)-
CID 553346
1,3,5-Cycloheptatriene, 7,7-dimethyl-2,5-bis(trimethylsilylmethyl)-
CID 553420
1,3,5-Cycloheptatriene, 7,7-dimethyl-2,4-bis(trimethylsilylmethyl)-
CID 553421
Bicyclo[5.3.0]deca-1(7),2,5-triene, 4,4-dimethyl-2,6-bis(trimethylsilyl)-
CID 553464
Bicyclo[5.4.0]undeca-1(7),2,5-triene, 5,5-dimethyl-2,9-bis(trimethylsilyl)-
CID 553540

Frequently Asked Questions

What is the IUPAC name of trimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane?
The IUPAC name of trimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane (CID 553398) is trimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane.
What is the SMILES notation for trimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane?
The canonical SMILES for trimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane is CC1=C(C)C([Si](C)(C)C)=CC(C)(C)C=C1[Si](C)(C)C.
What is the InChIKey of trimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane?
The InChIKey is XKIVZBCIWRTIOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32Si2/c1-13-14(2)16(19(8,9)10)12-17(3,4)11-15(13)18(5,6)7/h11-12H,1-10H3.
What are the key properties of trimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane?
trimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane has a molecular weight of 292.62 g/mol, XLogP of 5.97, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(3,3,6,7-tetramethyl-5-trimethylsilylcyclohepta-1,4,6-trien-1-yl)silane is sourced from PubChem (CID 553398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).