trimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane

C18H32Si — CID 15143647

IUPACtrimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane
SMILESCC1=C(/C=C/C(C)=C/C[Si](C)(C)C)C(C)(C)CCC1
InChIInChI=1S/C18H32Si/c1-15(12-14-19(5,6)7)10-11-17-16(2)9-8-13-18(17,3)4/h10-12H,8-9,13-14H2,1-7H3/b11-10+,15-12+
InChIKeyXXSFAYGNISYZIN-GCHFJXRNSA-N
MW276.54 g/mol
LogP6.35
Rot. Bonds4

About trimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane

trimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane (PubChem CID 15143647) has the molecular formula C18H32Si and a molecular weight of 276.54 g/mol. Its IUPAC name is trimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane.

Molecular Properties

Compound Nametrimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane
PubChem CID15143647
Molecular FormulaC18H32Si
Molecular Weight276.54 g/mol
Exact Mass276.23
IUPAC Nametrimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane
SMILESCC1=C(/C=C/C(C)=C/C[Si](C)(C)C)C(C)(C)CCC1
InChIInChI=1S/C18H32Si/c1-15(12-14-19(5,6)7)10-11-17-16(2)9-8-13-18(17,3)4/h10-12H,8-9,13-14H2,1-7H3/b11-10+,15-12+
InChIKeyXXSFAYGNISYZIN-GCHFJXRNSA-N
XLogP6.35
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.54
LogP ≤ 56.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze trimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane with MolForge

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Related Compounds

Beta-Carotene
CID 5280489
Torulene
CID 5281253
Axerophthene
CID 5287722
gamma-Carotene
CID 5280791
9-Cis-Beta-Carotene
CID 9828626
(13Z)-beta-Carotene
CID 10256668
Beta-Zeacarotene
CID 5280790
7,8-Dihydro-beta-carotene
CID 16061228
Tetrahydro-beta-carotene/eta-Carotene
CID 16061254
b-Carotene
CID 46783370
Neo-beta-carotene
CID 573
15-cis-beta-Carotene
CID 12305639

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane?
The IUPAC name of trimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane (CID 15143647) is trimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane.
What is the SMILES notation for trimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane?
The canonical SMILES for trimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane is CC1=C(/C=C/C(C)=C/C[Si](C)(C)C)C(C)(C)CCC1.
What is the InChIKey of trimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane?
The InChIKey is XXSFAYGNISYZIN-GCHFJXRNSA-N. The full InChI is InChI=1S/C18H32Si/c1-15(12-14-19(5,6)7)10-11-17-16(2)9-8-13-18(17,3)4/h10-12H,8-9,13-14H2,1-7H3/b11-10+,15-12+.
What are the key properties of trimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane?
trimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane has a molecular weight of 276.54 g/mol, XLogP of 6.35, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane is sourced from PubChem (CID 15143647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).