[(3-bromophenyl)-phenylmethoxy]-trimethylsilane

C16H19BrOSi — CID 18957458

IUPAC[(3-bromophenyl)-phenylmethoxy]-trimethylsilane
SMILESC[Si](C)(C)OC(c1ccccc1)c1cccc(Br)c1
InChIInChI=1S/C16H19BrOSi/c1-19(2,3)18-16(13-8-5-4-6-9-13)14-10-7-11-15(17)12-14/h4-12,16H,1-3H3
InChIKeyAJJHUYJLNNBSJT-UHFFFAOYSA-N
MW335.32 g/mol
LogP5.39
Rot. Bonds4

About [(3-bromophenyl)-phenylmethoxy]-trimethylsilane

[(3-bromophenyl)-phenylmethoxy]-trimethylsilane (PubChem CID 18957458) has the molecular formula C16H19BrOSi and a molecular weight of 335.32 g/mol. Its IUPAC name is [(3-bromophenyl)-phenylmethoxy]-trimethylsilane.

Molecular Properties

Compound Name[(3-bromophenyl)-phenylmethoxy]-trimethylsilane
PubChem CID18957458
Molecular FormulaC16H19BrOSi
Molecular Weight335.32 g/mol
Exact Mass334.04
IUPAC Name[(3-bromophenyl)-phenylmethoxy]-trimethylsilane
SMILESC[Si](C)(C)OC(c1ccccc1)c1cccc(Br)c1
InChIInChI=1S/C16H19BrOSi/c1-19(2,3)18-16(13-8-5-4-6-9-13)14-10-7-11-15(17)12-14/h4-12,16H,1-3H3
InChIKeyAJJHUYJLNNBSJT-UHFFFAOYSA-N
XLogP5.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.32
LogP ≤ 55.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 [(3-bromophenyl)-phenylmethoxy]-trimethylsilane?
The IUPAC name of [(3-bromophenyl)-phenylmethoxy]-trimethylsilane (CID 18957458) is [(3-bromophenyl)-phenylmethoxy]-trimethylsilane.
What is the SMILES notation for [(3-bromophenyl)-phenylmethoxy]-trimethylsilane?
The canonical SMILES for [(3-bromophenyl)-phenylmethoxy]-trimethylsilane is C[Si](C)(C)OC(c1ccccc1)c1cccc(Br)c1.
What is the InChIKey of [(3-bromophenyl)-phenylmethoxy]-trimethylsilane?
The InChIKey is AJJHUYJLNNBSJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19BrOSi/c1-19(2,3)18-16(13-8-5-4-6-9-13)14-10-7-11-15(17)12-14/h4-12,16H,1-3H3.
What are the key properties of [(3-bromophenyl)-phenylmethoxy]-trimethylsilane?
[(3-bromophenyl)-phenylmethoxy]-trimethylsilane has a molecular weight of 335.32 g/mol, XLogP of 5.39, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromophenyl)-phenylmethoxy]-trimethylsilane is sourced from PubChem (CID 18957458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).