bis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane

C24H47PSi2 — CID 101219188

IUPACbis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane
SMILESCC(C)c1cccc(C(C)C)c1P([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C24H47PSi2/c1-18(2)20-16-15-17-21(19(3)4)22(20)25(26(11,12)23(5,6)7)27(13,14)24(8,9)10/h15-19H,1-14H3
InChIKeyZOZXDBHPAYKWSF-UHFFFAOYSA-N
MW422.79 g/mol
LogP9.05
Rot. Bonds5

About bis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane

bis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane (PubChem CID 101219188) has the molecular formula C24H47PSi2 and a molecular weight of 422.79 g/mol. Its IUPAC name is bis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane.

Molecular Properties

Compound Namebis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane
PubChem CID101219188
Molecular FormulaC24H47PSi2
Molecular Weight422.79 g/mol
Exact Mass422.30
IUPAC Namebis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane
SMILESCC(C)c1cccc(C(C)C)c1P([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C24H47PSi2/c1-18(2)20-16-15-17-21(19(3)4)22(20)25(26(11,12)23(5,6)7)27(13,14)24(8,9)10/h15-19H,1-14H3
InChIKeyZOZXDBHPAYKWSF-UHFFFAOYSA-N
XLogP9.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.79
LogP ≤ 59.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane?
The IUPAC name of bis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane (CID 101219188) is bis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane.
What is the SMILES notation for bis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane?
The canonical SMILES for bis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane is CC(C)c1cccc(C(C)C)c1P([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C.
What is the InChIKey of bis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane?
The InChIKey is ZOZXDBHPAYKWSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H47PSi2/c1-18(2)20-16-15-17-21(19(3)4)22(20)25(26(11,12)23(5,6)7)27(13,14)24(8,9)10/h15-19H,1-14H3.
What are the key properties of bis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane?
bis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane has a molecular weight of 422.79 g/mol, XLogP of 9.05, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis[tert-butyl(dimethyl)silyl]-[2,6-di(propan-2-yl)phenyl]phosphane is sourced from PubChem (CID 101219188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).