[3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane

C18H38O2Si3 — CID 23115134

IUPAC[3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane
SMILESCC(C)[Si](C)(C)OC1=CC([Si](C)(C)C)C=C1O[Si](C)(C)C(C)C
InChIInChI=1S/C18H38O2Si3/c1-14(2)22(8,9)19-17-12-16(21(5,6)7)13-18(17)20-23(10,11)15(3)4/h12-16H,1-11H3
InChIKeyCKRXIYPBOATRDC-UHFFFAOYSA-N
MW370.76 g/mol
LogP6.74
Rot. Bonds7

About [3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane

[3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane (PubChem CID 23115134) has the molecular formula C18H38O2Si3 and a molecular weight of 370.76 g/mol. Its IUPAC name is [3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane.

Molecular Properties

Compound Name[3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane
PubChem CID23115134
Molecular FormulaC18H38O2Si3
Molecular Weight370.76 g/mol
Exact Mass370.22
IUPAC Name[3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane
SMILESCC(C)[Si](C)(C)OC1=CC([Si](C)(C)C)C=C1O[Si](C)(C)C(C)C
InChIInChI=1S/C18H38O2Si3/c1-14(2)22(8,9)19-17-12-16(21(5,6)7)13-18(17)20-23(10,11)15(3)4/h12-16H,1-11H3
InChIKeyCKRXIYPBOATRDC-UHFFFAOYSA-N
XLogP6.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.76
LogP ≤ 56.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane?
The IUPAC name of [3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane (CID 23115134) is [3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane.
What is the SMILES notation for [3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane?
The canonical SMILES for [3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane is CC(C)[Si](C)(C)OC1=CC([Si](C)(C)C)C=C1O[Si](C)(C)C(C)C.
What is the InChIKey of [3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane?
The InChIKey is CKRXIYPBOATRDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38O2Si3/c1-14(2)22(8,9)19-17-12-16(21(5,6)7)13-18(17)20-23(10,11)15(3)4/h12-16H,1-11H3.
What are the key properties of [3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane?
[3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane has a molecular weight of 370.76 g/mol, XLogP of 6.74, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3,4-bis[[dimethyl(propan-2-yl)silyl]oxy]cyclopenta-2,4-dien-1-yl]-trimethylsilane is sourced from PubChem (CID 23115134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).