(1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane

C28H26OSi — CID 164673947

IUPAC(1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane
SMILESC[Si](OC1(c2ccccc2)CC1c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H26OSi/c1-30(25-18-10-4-11-19-25,26-20-12-5-13-21-26)29-28(24-16-8-3-9-17-24)22-27(28)23-14-6-2-7-15-23/h2-21,27H,22H2,1H3
InChIKeyOGXCCRNHCWEQBL-UHFFFAOYSA-N
MW406.60 g/mol
LogP5.48
Rot. Bonds6

About (1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane

(1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane (PubChem CID 164673947) has the molecular formula C28H26OSi and a molecular weight of 406.60 g/mol. Its IUPAC name is (1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane.

Molecular Properties

Compound Name(1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane
PubChem CID164673947
Molecular FormulaC28H26OSi
Molecular Weight406.60 g/mol
Exact Mass406.18
IUPAC Name(1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane
SMILESC[Si](OC1(c2ccccc2)CC1c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C28H26OSi/c1-30(25-18-10-4-11-19-25,26-20-12-5-13-21-26)29-28(24-16-8-3-9-17-24)22-27(28)23-14-6-2-7-15-23/h2-21,27H,22H2,1H3
InChIKeyOGXCCRNHCWEQBL-UHFFFAOYSA-N
XLogP5.48
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.60
LogP ≤ 55.48
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 (1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane?
The IUPAC name of (1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane (CID 164673947) is (1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane.
What is the SMILES notation for (1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane?
The canonical SMILES for (1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane is C[Si](OC1(c2ccccc2)CC1c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of (1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane?
The InChIKey is OGXCCRNHCWEQBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26OSi/c1-30(25-18-10-4-11-19-25,26-20-12-5-13-21-26)29-28(24-16-8-3-9-17-24)22-27(28)23-14-6-2-7-15-23/h2-21,27H,22H2,1H3.
What are the key properties of (1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane?
(1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane has a molecular weight of 406.60 g/mol, XLogP of 5.48, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2-diphenylcyclopropyl)oxy-methyl-diphenylsilane is sourced from PubChem (CID 164673947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).