6-bromohexoxy-tri(propan-2-yl)silane

C15H33BrOSi — CID 89400609

IUPAC6-bromohexoxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](OCCCCCCBr)(C(C)C)C(C)C
InChIInChI=1S/C15H33BrOSi/c1-13(2)18(14(3)4,15(5)6)17-12-10-8-7-9-11-16/h13-15H,7-12H2,1-6H3
InChIKeyCZYNEJMLLNCFHX-UHFFFAOYSA-N
MW337.42 g/mol
LogP6.13
Rot. Bonds10

About 6-bromohexoxy-tri(propan-2-yl)silane

6-bromohexoxy-tri(propan-2-yl)silane (PubChem CID 89400609) has the molecular formula C15H33BrOSi and a molecular weight of 337.42 g/mol. Its IUPAC name is 6-bromohexoxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name6-bromohexoxy-tri(propan-2-yl)silane
PubChem CID89400609
Molecular FormulaC15H33BrOSi
Molecular Weight337.42 g/mol
Exact Mass336.15
IUPAC Name6-bromohexoxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](OCCCCCCBr)(C(C)C)C(C)C
InChIInChI=1S/C15H33BrOSi/c1-13(2)18(14(3)4,15(5)6)17-12-10-8-7-9-11-16/h13-15H,7-12H2,1-6H3
InChIKeyCZYNEJMLLNCFHX-UHFFFAOYSA-N
XLogP6.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.42
LogP ≤ 56.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-bromohexoxy-tri(propan-2-yl)silane?
The IUPAC name of 6-bromohexoxy-tri(propan-2-yl)silane (CID 89400609) is 6-bromohexoxy-tri(propan-2-yl)silane.
What is the SMILES notation for 6-bromohexoxy-tri(propan-2-yl)silane?
The canonical SMILES for 6-bromohexoxy-tri(propan-2-yl)silane is CC(C)[Si](OCCCCCCBr)(C(C)C)C(C)C.
What is the InChIKey of 6-bromohexoxy-tri(propan-2-yl)silane?
The InChIKey is CZYNEJMLLNCFHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33BrOSi/c1-13(2)18(14(3)4,15(5)6)17-12-10-8-7-9-11-16/h13-15H,7-12H2,1-6H3.
What are the key properties of 6-bromohexoxy-tri(propan-2-yl)silane?
6-bromohexoxy-tri(propan-2-yl)silane has a molecular weight of 337.42 g/mol, XLogP of 6.13, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromohexoxy-tri(propan-2-yl)silane is sourced from PubChem (CID 89400609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).