bromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide

C19H38BrSi4- — CID 102145892

IUPACbromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide
SMILESCc1cc(C)c([Si-](Br)C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)c(C)c1
InChIInChI=1S/C19H38BrSi4/c1-15-13-16(2)18(17(3)14-15)21(20)19(22(4,5)6,23(7,8)9)24(10,11)12/h13-14H,1-12H3/q-1
InChIKeyWNOGHRZKMULFAN-UHFFFAOYSA-N
MW458.76 g/mol
LogP6.58
Rot. Bonds5

About bromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide

bromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide (PubChem CID 102145892) has the molecular formula C19H38BrSi4- and a molecular weight of 458.76 g/mol. Its IUPAC name is bromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide.

Molecular Properties

Compound Namebromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide
PubChem CID102145892
Molecular FormulaC19H38BrSi4-
Molecular Weight458.76 g/mol
Exact Mass457.12
IUPAC Namebromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide
SMILESCc1cc(C)c([Si-](Br)C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)c(C)c1
InChIInChI=1S/C19H38BrSi4/c1-15-13-16(2)18(17(3)14-15)21(20)19(22(4,5)6,23(7,8)9)24(10,11)12/h13-14H,1-12H3/q-1
InChIKeyWNOGHRZKMULFAN-UHFFFAOYSA-N
XLogP6.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500458.76
LogP ≤ 56.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

trimethyl-[(2,4,6-trimethylphenyl)-bis(trimethylsilyl)silyl]silane
CID 15655090
(2,4,6-trimethylphenyl)-trimethylsilylphosphanide
CID 12736255
[chloro-bis(2,4,6-trimethylphenyl)methyl]silane
CID 173138613
bis[2-(2,4,6-trimethylphenyl)propan-2-yl]diazene
CID 10247336
2-bromo-N-[dimethyl-(2,3,4,5-tetramethylcyclopentyl)silyl]-4,6-dimethylaniline
CID 162299094
2-(2-bromo-4,6-dimethylphenyl)propan-2-amine
CID 84801577
N-[fluoro-bis[methyl(trimethylsilyl)amino]silyl]-2,4,6-trimethylaniline
CID 23234630
(3,5-dibromo-2-pyridinyl)-(2-fluoro-4,6-dimethylphenyl)methanol
CID 106880546
lithium (2,4,6-trimethylphenyl)-trimethylsilylazanide
CID 12699524
2-[dibromo-[[dibromo-(2,4,6-trimethylphenyl)-λ4-tellanyl]methyl]-λ4-tellanyl]-1,3,5-trimethylbenzene
CID 139206469
1,2-ditert-butyl-3,5-dimethylbenzene
CID 159753674
2-bromo-1-fluoro-3,5-dimethylbenzene;ethane
CID 142302945

Frequently Asked Questions

What is the IUPAC name of bromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide?
The IUPAC name of bromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide (CID 102145892) is bromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide.
What is the SMILES notation for bromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide?
The canonical SMILES for bromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide is Cc1cc(C)c([Si-](Br)C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)c(C)c1.
What is the InChIKey of bromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide?
The InChIKey is WNOGHRZKMULFAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38BrSi4/c1-15-13-16(2)18(17(3)14-15)21(20)19(22(4,5)6,23(7,8)9)24(10,11)12/h13-14H,1-12H3/q-1.
What are the key properties of bromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide?
bromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide has a molecular weight of 458.76 g/mol, XLogP of 6.58, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromo-(2,4,6-trimethylphenyl)-[tris(trimethylsilyl)methyl]silanide is sourced from PubChem (CID 102145892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).