trimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane

C24H44O2Si4 — CID 100951043

IUPACtrimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane
SMILESC[Si](C)(C)/C1=C(\[Si](C)(C)C)C2=C(COC2)/C([Si](C)(C)C)=C(/[Si](C)(C)C)C2=C1COC2
InChIInChI=1S/C24H44O2Si4/c1-27(2,3)21-17-13-25-14-18(17)23(29(7,8)9)24(30(10,11)12)20-16-26-15-19(20)22(21)28(4,5)6/h13-16H2,1-12H3/b21-17+,22-19+,22-21-,23-18+,24-20+,24-23-
InChIKeyJKNMKAJJEBKZKF-ZETWBMFLSA-N
MW476.96 g/mol
LogP6.76
Rot. Bonds4

About trimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane

trimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane (PubChem CID 100951043) has the molecular formula C24H44O2Si4 and a molecular weight of 476.96 g/mol. Its IUPAC name is trimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane.

Molecular Properties

Compound Nametrimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane
PubChem CID100951043
Molecular FormulaC24H44O2Si4
Molecular Weight476.96 g/mol
Exact Mass476.24
IUPAC Nametrimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane
SMILESC[Si](C)(C)/C1=C(\[Si](C)(C)C)C2=C(COC2)/C([Si](C)(C)C)=C(/[Si](C)(C)C)C2=C1COC2
InChIInChI=1S/C24H44O2Si4/c1-27(2,3)21-17-13-25-14-18(17)23(29(7,8)9)24(30(10,11)12)20-16-26-15-19(20)22(21)28(4,5)6/h13-16H2,1-12H3/b21-17+,22-19+,22-21-,23-18+,24-20+,24-23-
InChIKeyJKNMKAJJEBKZKF-ZETWBMFLSA-N
XLogP6.76
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500476.96
LogP ≤ 56.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze trimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane with MolForge

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Related Compounds

trimethyl-[(4E,6Z,8E)-5,6,7,8-tetraethyl-4-trimethylsilyl-1,3-dihydrocycloocta[c]furan-9-yl]silane
CID 10993124
4,6-Bis[tri(propan-2-yl)silyl]-1,3-dihydrocyclopenta[c]furan-5-one
CID 71603289
[(4E,6Z,8E)-7,8-diethyl-5,6-dipropyl-4-trimethylsilyl-1,3-dihydrocycloocta[c]furan-9-yl]-trimethylsilane
CID 15430740
[(3aZ,5Z,7Z,9Z)-5,6,7,8-tetraethyl-4-trimethylsilyl-1,3-dihydrocycloocta[c]furan-9-yl]-trimethylsilane
CID 15972072
4,6-Bis(triethylsilyl)-1,3-dihydrocyclopenta[c]furan-5-one
CID 85819599

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane?
The IUPAC name of trimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane (CID 100951043) is trimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane.
What is the SMILES notation for trimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane?
The canonical SMILES for trimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane is C[Si](C)(C)/C1=C(\[Si](C)(C)C)C2=C(COC2)/C([Si](C)(C)C)=C(/[Si](C)(C)C)C2=C1COC2.
What is the InChIKey of trimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane?
The InChIKey is JKNMKAJJEBKZKF-ZETWBMFLSA-N. The full InChI is InChI=1S/C24H44O2Si4/c1-27(2,3)21-17-13-25-14-18(17)23(29(7,8)9)24(30(10,11)12)20-16-26-15-19(20)22(21)28(4,5)6/h13-16H2,1-12H3/b21-17+,22-19+,22-21-,23-18+,24-20+,24-23-.
What are the key properties of trimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane?
trimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane has a molecular weight of 476.96 g/mol, XLogP of 6.76, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(2Z,9Z)-3,9,10-tris(trimethylsilyl)-6,13-dioxatricyclo[9.3.0.04,8]tetradeca-1(11),2,4(8),9-tetraen-2-yl]silane is sourced from PubChem (CID 100951043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).