Silane, bromobis(1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl)-

C20H30BrSi — CID 6389189

IUPAC—
SMILESCC1=C(C)C(C)([Si](Br)C2(C)C(C)=C(C)C(C)=C2C)C(C)=C1C
InChIInChI=1S/C20H30BrSi/c1-11-12(2)16(6)19(9,15(11)5)22(21)20(10)17(7)13(3)14(4)18(20)8/h1-10H3
InChIKeyVATMWEFIYBULMW-UHFFFAOYSA-N
MW378.45 g/mol
LogP7.27
Rot. Bonds2

About Silane, bromobis(1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl)-

Silane, bromobis(1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl)- (PubChem CID 6389189) has the molecular formula C20H30BrSi and a molecular weight of 378.45 g/mol.

Molecular Properties

Compound NameSilane, bromobis(1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl)-
PubChem CID6389189
Molecular FormulaC20H30BrSi
Molecular Weight378.45 g/mol
Exact Mass377.13
IUPAC Name—
SMILESCC1=C(C)C(C)([Si](Br)C2(C)C(C)=C(C)C(C)=C2C)C(C)=C1C
InChIInChI=1S/C20H30BrSi/c1-11-12(2)16(6)19(9,15(11)5)22(21)20(10)17(7)13(3)14(4)18(20)8/h1-10H3
InChIKeyVATMWEFIYBULMW-UHFFFAOYSA-N
XLogP7.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.45
LogP ≤ 57.27
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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Frequently Asked Questions

What is the IUPAC name of Silane, bromobis(1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl)-?
The IUPAC name of Silane, bromobis(1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl)- (CID 6389189) is not available.
What is the SMILES notation for Silane, bromobis(1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl)-?
The canonical SMILES for Silane, bromobis(1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl)- is CC1=C(C)C(C)([Si](Br)C2(C)C(C)=C(C)C(C)=C2C)C(C)=C1C.
What is the InChIKey of Silane, bromobis(1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl)-?
The InChIKey is VATMWEFIYBULMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30BrSi/c1-11-12(2)16(6)19(9,15(11)5)22(21)20(10)17(7)13(3)14(4)18(20)8/h1-10H3.
What are the key properties of Silane, bromobis(1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl)-?
Silane, bromobis(1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl)- has a molecular weight of 378.45 g/mol, XLogP of 7.27, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for Silane, bromobis(1,2,3,4,5-pentamethyl-2,4-cyclopentadien-1-yl)- is sourced from PubChem (CID 6389189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).