(4-bromophenoxy)-tri(propan-2-yl)silane

C15H25BrOSi — CID 536194

IUPAC(4-bromophenoxy)-tri(propan-2-yl)silane
SMILESCC(C)[Si](Oc1ccc(Br)cc1)(C(C)C)C(C)C
InChIInChI=1S/C15H25BrOSi/c1-11(2)18(12(3)4,13(5)6)17-15-9-7-14(16)8-10-15/h7-13H,1-6H3
InChIKeyHFFWXPIQBUOVFO-UHFFFAOYSA-N
MW329.35 g/mol
LogP6.00
Rot. Bonds5

About (4-bromophenoxy)-tri(propan-2-yl)silane

(4-bromophenoxy)-tri(propan-2-yl)silane (PubChem CID 536194) has the molecular formula C15H25BrOSi and a molecular weight of 329.35 g/mol. Its IUPAC name is (4-bromophenoxy)-tri(propan-2-yl)silane.

Molecular Properties

Compound Name(4-bromophenoxy)-tri(propan-2-yl)silane
PubChem CID536194
Molecular FormulaC15H25BrOSi
Molecular Weight329.35 g/mol
Exact Mass328.09
IUPAC Name(4-bromophenoxy)-tri(propan-2-yl)silane
SMILESCC(C)[Si](Oc1ccc(Br)cc1)(C(C)C)C(C)C
InChIInChI=1S/C15H25BrOSi/c1-11(2)18(12(3)4,13(5)6)17-15-9-7-14(16)8-10-15/h7-13H,1-6H3
InChIKeyHFFWXPIQBUOVFO-UHFFFAOYSA-N
XLogP6.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.35
LogP ≤ 56.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

CID 87350
CID 87350
CID 4227167
CID 4227167
CID 11219912
CID 11219912
CID 11292808
CID 11292808
CID 615801
CID 615801
CID 11254705
CID 11254705
CID 522069
CID 522069
CID 529235
CID 529235
CID 628162
CID 628162
CID 11015115
CID 11015115
CID 72945070
CID 72945070
CID 11332921
CID 11332921

Frequently Asked Questions

What is the IUPAC name of (4-bromophenoxy)-tri(propan-2-yl)silane?
The IUPAC name of (4-bromophenoxy)-tri(propan-2-yl)silane (CID 536194) is (4-bromophenoxy)-tri(propan-2-yl)silane.
What is the SMILES notation for (4-bromophenoxy)-tri(propan-2-yl)silane?
The canonical SMILES for (4-bromophenoxy)-tri(propan-2-yl)silane is CC(C)[Si](Oc1ccc(Br)cc1)(C(C)C)C(C)C.
What is the InChIKey of (4-bromophenoxy)-tri(propan-2-yl)silane?
The InChIKey is HFFWXPIQBUOVFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25BrOSi/c1-11(2)18(12(3)4,13(5)6)17-15-9-7-14(16)8-10-15/h7-13H,1-6H3.
What are the key properties of (4-bromophenoxy)-tri(propan-2-yl)silane?
(4-bromophenoxy)-tri(propan-2-yl)silane has a molecular weight of 329.35 g/mol, XLogP of 6.00, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromophenoxy)-tri(propan-2-yl)silane is sourced from PubChem (CID 536194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).