tri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane

C34H56O3Si2 — CID 102345110

IUPACtri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane
SMILESCC(C)[Si](Oc1ccc(C2(c3ccc(O[Si](C(C)C)(C(C)C)C(C)C)cc3)CCCO2)cc1)(C(C)C)C(C)C
InChIInChI=1S/C34H56O3Si2/c1-24(2)38(25(3)4,26(5)6)36-32-18-14-30(15-19-32)34(22-13-23-35-34)31-16-20-33(21-17-31)37-39(27(7)8,28(9)10)29(11)12/h14-21,24-29H,13,22-23H2,1-12H3
InChIKeyVJLYJTZCTFAENN-UHFFFAOYSA-N
MW568.99 g/mol
LogP10.85
Rot. Bonds12

About tri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane

tri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane (PubChem CID 102345110) has the molecular formula C34H56O3Si2 and a molecular weight of 568.99 g/mol. Its IUPAC name is tri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane.

Molecular Properties

Compound Nametri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane
PubChem CID102345110
Molecular FormulaC34H56O3Si2
Molecular Weight568.99 g/mol
Exact Mass568.38
IUPAC Nametri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane
SMILESCC(C)[Si](Oc1ccc(C2(c3ccc(O[Si](C(C)C)(C(C)C)C(C)C)cc3)CCCO2)cc1)(C(C)C)C(C)C
InChIInChI=1S/C34H56O3Si2/c1-24(2)38(25(3)4,26(5)6)36-32-18-14-30(15-19-32)34(22-13-23-35-34)31-16-20-33(21-17-31)37-39(27(7)8,28(9)10)29(11)12/h14-21,24-29H,13,22-23H2,1-12H3
InChIKeyVJLYJTZCTFAENN-UHFFFAOYSA-N
XLogP10.85
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500568.99
LogP ≤ 510.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 tri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane?
The IUPAC name of tri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane (CID 102345110) is tri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane.
What is the SMILES notation for tri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane?
The canonical SMILES for tri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane is CC(C)[Si](Oc1ccc(C2(c3ccc(O[Si](C(C)C)(C(C)C)C(C)C)cc3)CCCO2)cc1)(C(C)C)C(C)C.
What is the InChIKey of tri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane?
The InChIKey is VJLYJTZCTFAENN-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H56O3Si2/c1-24(2)38(25(3)4,26(5)6)36-32-18-14-30(15-19-32)34(22-13-23-35-34)31-16-20-33(21-17-31)37-39(27(7)8,28(9)10)29(11)12/h14-21,24-29H,13,22-23H2,1-12H3.
What are the key properties of tri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane?
tri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane has a molecular weight of 568.99 g/mol, XLogP of 10.85, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tri(propan-2-yl)-[4-[2-[4-tri(propan-2-yl)silyloxyphenyl]oxolan-2-yl]phenoxy]silane is sourced from PubChem (CID 102345110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).