trimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane

C20H34Si2 — CID 101482142

IUPACtrimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane
SMILESC[Si](C)(C)[C@@H]1C=CC=C[C@@H]([C@@H]2C=CC=C[C@@H]([Si](C)(C)C)C2)C1
InChIInChI=1S/C20H34Si2/c1-21(2,3)19-13-9-7-11-17(15-19)18-12-8-10-14-20(16-18)22(4,5)6/h7-14,17-20H,15-16H2,1-6H3/t17-,18-,19-,20-/m1/s1
InChIKeySZYJBEPBXKDSKK-UAFMIMERSA-N
MW330.66 g/mol
LogP6.67
Rot. Bonds3

About trimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane

trimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane (PubChem CID 101482142) has the molecular formula C20H34Si2 and a molecular weight of 330.66 g/mol. Its IUPAC name is trimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane.

Molecular Properties

Compound Nametrimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane
PubChem CID101482142
Molecular FormulaC20H34Si2
Molecular Weight330.66 g/mol
Exact Mass330.22
IUPAC Nametrimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane
SMILESC[Si](C)(C)[C@@H]1C=CC=C[C@@H]([C@@H]2C=CC=C[C@@H]([Si](C)(C)C)C2)C1
InChIInChI=1S/C20H34Si2/c1-21(2,3)19-13-9-7-11-17(15-19)18-12-8-10-14-20(16-18)22(4,5)6/h7-14,17-20H,15-16H2,1-6H3/t17-,18-,19-,20-/m1/s1
InChIKeySZYJBEPBXKDSKK-UAFMIMERSA-N
XLogP6.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.66
LogP ≤ 56.67
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

trimethyl-(3-trimethylsilyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silane
CID 123227996
7-methylbicyclo[4.2.0]octa-2,4-diene
CID 14703991
2-propan-2-yl-2,3,3a,7a-tetrahydro-1H-indene
CID 19746881
trimethyl-[(1S,2S,3R,4R,5R,6R)-4-trimethylsilyl-3-tricyclo[4.2.1.02,5]non-7-enyl]silane
CID 101474513
2-bromo-2,3,3a,7a-tetrahydro-1H-indene
CID 91335355
(1S)-1,2-dimethyl-2,3,3a,7a-tetrahydro-1H-indene
CID 140862858
(1,3-dimethyl-2,3,3a,7a-tetrahydro-1H-inden-2-yl)-dimethyl-(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silane
CID 156675189
carbanide;dichlorozirconium(2+);dimethyl-bis(2-methyl-2,3,3a,7a-tetrahydro-1H-inden-1-yl)silane
CID 162298480
tetracyclo[7.7.1.02,7.010,15]heptadeca-3,5,11,13-tetraene
CID 59047597
methyl (1R,5S)-5-trimethylsilylcyclohex-3-ene-1-carboxylate
CID 134944041
bis(2,3,3a,7a-tetrahydro-1H-inden-3-id-2-yl)-dimethylsilane;titanium(2+)
CID 173133140
bis(2,3,3a,7a-tetrahydro-1H-inden-1-yl)-dimethylsilane;bis(dimethylazanide);zirconium(4+)
CID 23230084

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane?
The IUPAC name of trimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane (CID 101482142) is trimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane.
What is the SMILES notation for trimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane?
The canonical SMILES for trimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane is C[Si](C)(C)[C@@H]1C=CC=C[C@@H]([C@@H]2C=CC=C[C@@H]([Si](C)(C)C)C2)C1.
What is the InChIKey of trimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane?
The InChIKey is SZYJBEPBXKDSKK-UAFMIMERSA-N. The full InChI is InChI=1S/C20H34Si2/c1-21(2,3)19-13-9-7-11-17(15-19)18-12-8-10-14-20(16-18)22(4,5)6/h7-14,17-20H,15-16H2,1-6H3/t17-,18-,19-,20-/m1/s1.
What are the key properties of trimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane?
trimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane has a molecular weight of 330.66 g/mol, XLogP of 6.67, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(1S,6S)-6-[(1S,6S)-6-trimethylsilylcyclohepta-2,4-dien-1-yl]cyclohepta-2,4-dien-1-yl]silane is sourced from PubChem (CID 101482142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).