tri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane

C22H42Si2 — CID 11405807

IUPACtri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane
SMILESCC(C)[Si](C#CC#C[Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C22H42Si2/c1-17(2)23(18(3)4,19(5)6)15-13-14-16-24(20(7)8,21(9)10)22(11)12/h17-22H,1-12H3
InChIKeyOICLCUORDURFKG-UHFFFAOYSA-N
MW362.75 g/mol
LogP7.43
Rot. Bonds6

About tri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane

tri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane (PubChem CID 11405807) has the molecular formula C22H42Si2 and a molecular weight of 362.75 g/mol. Its IUPAC name is tri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane.

Molecular Properties

Compound Nametri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane
PubChem CID11405807
Molecular FormulaC22H42Si2
Molecular Weight362.75 g/mol
Exact Mass362.28
IUPAC Nametri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane
SMILESCC(C)[Si](C#CC#C[Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C22H42Si2/c1-17(2)23(18(3)4,19(5)6)15-13-14-16-24(20(7)8,21(9)10)22(11)12/h17-22H,1-12H3
InChIKeyOICLCUORDURFKG-UHFFFAOYSA-N
XLogP7.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.75
LogP ≤ 57.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane?
The IUPAC name of tri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane (CID 11405807) is tri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane.
What is the SMILES notation for tri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane?
The canonical SMILES for tri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane is CC(C)[Si](C#CC#C[Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C.
What is the InChIKey of tri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane?
The InChIKey is OICLCUORDURFKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H42Si2/c1-17(2)23(18(3)4,19(5)6)15-13-14-16-24(20(7)8,21(9)10)22(11)12/h17-22H,1-12H3.
What are the key properties of tri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane?
tri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane has a molecular weight of 362.75 g/mol, XLogP of 7.43, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tri(propan-2-yl)-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]silane is sourced from PubChem (CID 11405807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).