(3,5-ditert-butylphenyl)-diphenylsilane

C26H32Si — CID 150839348

IUPAC(3,5-ditert-butylphenyl)-diphenylsilane
SMILESCC(C)(C)c1cc([SiH](c2ccccc2)c2ccccc2)cc(C(C)(C)C)c1
InChIInChI=1S/C26H32Si/c1-25(2,3)20-17-21(26(4,5)6)19-24(18-20)27(22-13-9-7-10-14-22)23-15-11-8-12-16-23/h7-19,27H,1-6H3
InChIKeyKNQPQXIDJFXWPS-UHFFFAOYSA-N
MW372.63 g/mol
LogP4.53
Rot. Bonds3

About (3,5-ditert-butylphenyl)-diphenylsilane

(3,5-ditert-butylphenyl)-diphenylsilane (PubChem CID 150839348) has the molecular formula C26H32Si and a molecular weight of 372.63 g/mol. Its IUPAC name is (3,5-ditert-butylphenyl)-diphenylsilane.

Molecular Properties

Compound Name(3,5-ditert-butylphenyl)-diphenylsilane
PubChem CID150839348
Molecular FormulaC26H32Si
Molecular Weight372.63 g/mol
Exact Mass372.23
IUPAC Name(3,5-ditert-butylphenyl)-diphenylsilane
SMILESCC(C)(C)c1cc([SiH](c2ccccc2)c2ccccc2)cc(C(C)(C)C)c1
InChIInChI=1S/C26H32Si/c1-25(2,3)20-17-21(26(4,5)6)19-24(18-20)27(22-13-9-7-10-14-22)23-15-11-8-12-16-23/h7-19,27H,1-6H3
InChIKeyKNQPQXIDJFXWPS-UHFFFAOYSA-N
XLogP4.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.63
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

tert-butylbenzene;molecular nitrogen
CID 146464751
1,1'-biphenyl;tetrakis(1,3-ditert-butyl-5-methylbenzene)
CID 175093014
terbium;bis(1,3,5-tritert-butylbenzene)
CID 134902614
(3,5-ditert-butylphenyl)-triphenylboranuide
CID 140663046
CID 171375456
CID 171375456
tert-butylbenzene;1-tert-butyl-3,5-dimethylbenzene
CID 165052129
ethane;methane;1,3,5-tritert-butylbenzene
CID 144683024
1,3-ditert-butyl-5-(3-phenylpropyl)benzene
CID 101326636
tert-butylbenzene;2,2-dimethylpropane;methane
CID 160959011
benzene;tert-butylbenzene;bis(2,2-dimethylpropane);ethane
CID 158670454
tert-butylbenzene;chloromethane;ethane
CID 91149652
alumane;1,3-ditert-butylbenzene
CID 174392215

Frequently Asked Questions

What is the IUPAC name of (3,5-ditert-butylphenyl)-diphenylsilane?
The IUPAC name of (3,5-ditert-butylphenyl)-diphenylsilane (CID 150839348) is (3,5-ditert-butylphenyl)-diphenylsilane.
What is the SMILES notation for (3,5-ditert-butylphenyl)-diphenylsilane?
The canonical SMILES for (3,5-ditert-butylphenyl)-diphenylsilane is CC(C)(C)c1cc([SiH](c2ccccc2)c2ccccc2)cc(C(C)(C)C)c1.
What is the InChIKey of (3,5-ditert-butylphenyl)-diphenylsilane?
The InChIKey is KNQPQXIDJFXWPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H32Si/c1-25(2,3)20-17-21(26(4,5)6)19-24(18-20)27(22-13-9-7-10-14-22)23-15-11-8-12-16-23/h7-19,27H,1-6H3.
What are the key properties of (3,5-ditert-butylphenyl)-diphenylsilane?
(3,5-ditert-butylphenyl)-diphenylsilane has a molecular weight of 372.63 g/mol, XLogP of 4.53, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-ditert-butylphenyl)-diphenylsilane is sourced from PubChem (CID 150839348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).