(3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane

C14H28Si2 — CID 552974

IUPAC(3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane
SMILESCC1C=CC(C)C([Si](C)(C)C)=C1[Si](C)(C)C
InChIInChI=1S/C14H28Si2/c1-11-9-10-12(2)14(16(6,7)8)13(11)15(3,4)5/h9-12H,1-8H3
InChIKeyIIPCDSBUWALMEX-UHFFFAOYSA-N
MW252.55 g/mol
LogP4.88
Rot. Bonds2

About (3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane

(3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane (PubChem CID 552974) has the molecular formula C14H28Si2 and a molecular weight of 252.55 g/mol. Its IUPAC name is (3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane.

Molecular Properties

Compound Name(3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane
PubChem CID552974
Molecular FormulaC14H28Si2
Molecular Weight252.55 g/mol
Exact Mass252.17
IUPAC Name(3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane
SMILESCC1C=CC(C)C([Si](C)(C)C)=C1[Si](C)(C)C
InChIInChI=1S/C14H28Si2/c1-11-9-10-12(2)14(16(6,7)8)13(11)15(3,4)5/h9-12H,1-8H3
InChIKeyIIPCDSBUWALMEX-UHFFFAOYSA-N
XLogP4.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.55
LogP ≤ 54.88
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'}

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Related Compounds

3,6-Bis(trimethylsilyl)-1,4-cyclohexadiene
CID 143159
Silane, trimethyl-3-penten-2-yl-, trans
CID 5366362
Silane, trimethyl-2-pentenyl-, (E)-
CID 5366396
2,6-Octadiene, 1,8-bis(trimethylsilyl)-
CID 5366561
Silane, triethyl-2-pentenyl-, (Z)-
CID 5370496
trimethyl-[(E)-4-methylpent-2-enyl]silane
CID 10986493
5-Methyl-2,6-cis-heptadienyltrimethylsilane
CID 12550622
[(Z)-4,4-dimethylpent-2-enyl]-trimethylsilane
CID 13215156
trimethyl-[(Z)-4-methylpent-2-enyl]silane
CID 13530519
Trimethyl[(2E)-1-methyl-2-butenyl]silane
CID 552124
2-Pentenyltrimethylsilane
CID 552260
Silane, 2,6-octadiene-1,8-diylbis[trimethyl-
CID 552891

Frequently Asked Questions

What is the IUPAC name of (3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane?
The IUPAC name of (3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane (CID 552974) is (3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane.
What is the SMILES notation for (3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane?
The canonical SMILES for (3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane is CC1C=CC(C)C([Si](C)(C)C)=C1[Si](C)(C)C.
What is the InChIKey of (3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane?
The InChIKey is IIPCDSBUWALMEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28Si2/c1-11-9-10-12(2)14(16(6,7)8)13(11)15(3,4)5/h9-12H,1-8H3.
What are the key properties of (3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane?
(3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane has a molecular weight of 252.55 g/mol, XLogP of 4.88, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3,6-dimethyl-2-trimethylsilylcyclohexa-1,4-dien-1-yl)-trimethylsilane is sourced from PubChem (CID 552974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).