methyl-bis(2,3,5,6-tetramethylphenyl)silanylium

C21H31Si+ — CID 102529630

IUPACmethyl-bis(2,3,5,6-tetramethylphenyl)silanylium
SMILESCc1cc(C)c(C)c([SiH2+](C)c2c(C)c(C)cc(C)c2C)c1C
InChIInChI=1S/C21H31Si/c1-12-10-13(2)17(6)20(16(12)5)22(9)21-18(7)14(3)11-15(4)19(21)8/h10-11H,22H2,1-9H3/q+1
InChIKeyWMJQWHYVWVHXEZ-UHFFFAOYSA-N
MW311.57 g/mol
LogP3.86
Rot. Bonds2

About methyl-bis(2,3,5,6-tetramethylphenyl)silanylium

methyl-bis(2,3,5,6-tetramethylphenyl)silanylium (PubChem CID 102529630) has the molecular formula C21H31Si+ and a molecular weight of 311.57 g/mol. Its IUPAC name is methyl-bis(2,3,5,6-tetramethylphenyl)silanylium.

Molecular Properties

Compound Namemethyl-bis(2,3,5,6-tetramethylphenyl)silanylium
PubChem CID102529630
Molecular FormulaC21H31Si+
Molecular Weight311.57 g/mol
Exact Mass311.22
IUPAC Namemethyl-bis(2,3,5,6-tetramethylphenyl)silanylium
SMILESCc1cc(C)c(C)c([SiH2+](C)c2c(C)c(C)cc(C)c2C)c1C
InChIInChI=1S/C21H31Si/c1-12-10-13(2)17(6)20(16(12)5)22(9)21-18(7)14(3)11-15(4)19(21)8/h10-11H,22H2,1-9H3/q+1
InChIKeyWMJQWHYVWVHXEZ-UHFFFAOYSA-N
XLogP3.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.57
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 methyl-bis(2,3,5,6-tetramethylphenyl)silanylium?
The IUPAC name of methyl-bis(2,3,5,6-tetramethylphenyl)silanylium (CID 102529630) is methyl-bis(2,3,5,6-tetramethylphenyl)silanylium.
What is the SMILES notation for methyl-bis(2,3,5,6-tetramethylphenyl)silanylium?
The canonical SMILES for methyl-bis(2,3,5,6-tetramethylphenyl)silanylium is Cc1cc(C)c(C)c([SiH2+](C)c2c(C)c(C)cc(C)c2C)c1C.
What is the InChIKey of methyl-bis(2,3,5,6-tetramethylphenyl)silanylium?
The InChIKey is WMJQWHYVWVHXEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H31Si/c1-12-10-13(2)17(6)20(16(12)5)22(9)21-18(7)14(3)11-15(4)19(21)8/h10-11H,22H2,1-9H3/q+1.
What are the key properties of methyl-bis(2,3,5,6-tetramethylphenyl)silanylium?
methyl-bis(2,3,5,6-tetramethylphenyl)silanylium has a molecular weight of 311.57 g/mol, XLogP of 3.86, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-bis(2,3,5,6-tetramethylphenyl)silanylium is sourced from PubChem (CID 102529630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).