3-(2-chlorophenyl)propyl-diphenylsilane

C21H21ClSi — CID 3425752

IUPAC3-(2-chlorophenyl)propyl-diphenylsilane
SMILESClc1ccccc1CCC[SiH](c1ccccc1)c1ccccc1
InChIInChI=1S/C21H21ClSi/c22-21-16-8-7-10-18(21)11-9-17-23(19-12-3-1-4-13-19)20-14-5-2-6-15-20/h1-8,10,12-16,23H,9,11,17H2
InChIKeyHNXMLQUUECGAFS-UHFFFAOYSA-N
MW336.94 g/mol
LogP4.31
Rot. Bonds6

About 3-(2-chlorophenyl)propyl-diphenylsilane

3-(2-chlorophenyl)propyl-diphenylsilane (PubChem CID 3425752) has the molecular formula C21H21ClSi and a molecular weight of 336.94 g/mol. Its IUPAC name is 3-(2-chlorophenyl)propyl-diphenylsilane.

Molecular Properties

Compound Name3-(2-chlorophenyl)propyl-diphenylsilane
PubChem CID3425752
Molecular FormulaC21H21ClSi
Molecular Weight336.94 g/mol
Exact Mass336.11
IUPAC Name3-(2-chlorophenyl)propyl-diphenylsilane
SMILESClc1ccccc1CCC[SiH](c1ccccc1)c1ccccc1
InChIInChI=1S/C21H21ClSi/c22-21-16-8-7-10-18(21)11-9-17-23(19-12-3-1-4-13-19)20-14-5-2-6-15-20/h1-8,10,12-16,23H,9,11,17H2
InChIKeyHNXMLQUUECGAFS-UHFFFAOYSA-N
XLogP4.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.94
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

azane;1-butyl-2-chlorobenzene
CID 19011342
1-chloro-2-(13-chlorotridecyl)benzene
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1-chloro-2-[3-(4-phenylphenyl)propyl]benzene
CID 173254966
1-chloro-2-(3-phenoxypropyl)benzene
CID 174487660
1-chloro-2-(2-phenylethyl)benzene
CID 21495838
azane;2-(2-chlorophenyl)ethanamine
CID 70087147
1-(8-bromooctyl)-2-chlorobenzene
CID 18786455
1-chloro-2-(2-chloroethyl)benzene
CID 12587535
16-(2-chlorophenyl)hexadecanoic acid
CID 174356057
5-(2-chlorophenyl)pentyl-triphenylphosphanium;hydrobromide
CID 175145177
2-(2-chlorophenyl)-N-[2-(2-chlorophenyl)ethyl]ethanamine
CID 70453735
1-chloro-2-(3-nitropropyl)benzene
CID 57029813

Frequently Asked Questions

What is the IUPAC name of 3-(2-chlorophenyl)propyl-diphenylsilane?
The IUPAC name of 3-(2-chlorophenyl)propyl-diphenylsilane (CID 3425752) is 3-(2-chlorophenyl)propyl-diphenylsilane.
What is the SMILES notation for 3-(2-chlorophenyl)propyl-diphenylsilane?
The canonical SMILES for 3-(2-chlorophenyl)propyl-diphenylsilane is Clc1ccccc1CCC[SiH](c1ccccc1)c1ccccc1.
What is the InChIKey of 3-(2-chlorophenyl)propyl-diphenylsilane?
The InChIKey is HNXMLQUUECGAFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21ClSi/c22-21-16-8-7-10-18(21)11-9-17-23(19-12-3-1-4-13-19)20-14-5-2-6-15-20/h1-8,10,12-16,23H,9,11,17H2.
What are the key properties of 3-(2-chlorophenyl)propyl-diphenylsilane?
3-(2-chlorophenyl)propyl-diphenylsilane has a molecular weight of 336.94 g/mol, XLogP of 4.31, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chlorophenyl)propyl-diphenylsilane is sourced from PubChem (CID 3425752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).