1,3-dibromo-1,3-dipropyl-1,3-disiletane

C8H18Br2Si2 — CID 163405857

IUPAC1,3-dibromo-1,3-dipropyl-1,3-disiletane
SMILESCCC[Si]1(Br)C[Si](Br)(CCC)C1
InChIInChI=1S/C8H18Br2Si2/c1-3-5-11(9)7-12(10,8-11)6-4-2/h3-8H2,1-2H3
InChIKeyXXTLVTZNGJYTEF-UHFFFAOYSA-N
MW330.21 g/mol
LogP4.58
Rot. Bonds4

About 1,3-dibromo-1,3-dipropyl-1,3-disiletane

1,3-dibromo-1,3-dipropyl-1,3-disiletane (PubChem CID 163405857) has the molecular formula C8H18Br2Si2 and a molecular weight of 330.21 g/mol. Its IUPAC name is 1,3-dibromo-1,3-dipropyl-1,3-disiletane.

Molecular Properties

Compound Name1,3-dibromo-1,3-dipropyl-1,3-disiletane
PubChem CID163405857
Molecular FormulaC8H18Br2Si2
Molecular Weight330.21 g/mol
Exact Mass327.93
IUPAC Name1,3-dibromo-1,3-dipropyl-1,3-disiletane
SMILESCCC[Si]1(Br)C[Si](Br)(CCC)C1
InChIInChI=1S/C8H18Br2Si2/c1-3-5-11(9)7-12(10,8-11)6-4-2/h3-8H2,1-2H3
InChIKeyXXTLVTZNGJYTEF-UHFFFAOYSA-N
XLogP4.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.21
LogP ≤ 54.58
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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Frequently Asked Questions

What is the IUPAC name of 1,3-dibromo-1,3-dipropyl-1,3-disiletane?
The IUPAC name of 1,3-dibromo-1,3-dipropyl-1,3-disiletane (CID 163405857) is 1,3-dibromo-1,3-dipropyl-1,3-disiletane.
What is the SMILES notation for 1,3-dibromo-1,3-dipropyl-1,3-disiletane?
The canonical SMILES for 1,3-dibromo-1,3-dipropyl-1,3-disiletane is CCC[Si]1(Br)C[Si](Br)(CCC)C1.
What is the InChIKey of 1,3-dibromo-1,3-dipropyl-1,3-disiletane?
The InChIKey is XXTLVTZNGJYTEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18Br2Si2/c1-3-5-11(9)7-12(10,8-11)6-4-2/h3-8H2,1-2H3.
What are the key properties of 1,3-dibromo-1,3-dipropyl-1,3-disiletane?
1,3-dibromo-1,3-dipropyl-1,3-disiletane has a molecular weight of 330.21 g/mol, XLogP of 4.58, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dibromo-1,3-dipropyl-1,3-disiletane is sourced from PubChem (CID 163405857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).