dichloro-cyclohexyl-(4-methoxyphenyl)silane

C13H18Cl2OSi — CID 15514740

IUPACdichloro-cyclohexyl-(4-methoxyphenyl)silane
SMILESCOc1ccc([Si](Cl)(Cl)C2CCCCC2)cc1
InChIInChI=1S/C13H18Cl2OSi/c1-16-11-7-9-13(10-8-11)17(14,15)12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3
InChIKeyNJQKRNXPMGCQBL-UHFFFAOYSA-N
MW289.28 g/mol
LogP4.16
Rot. Bonds3

About dichloro-cyclohexyl-(4-methoxyphenyl)silane

dichloro-cyclohexyl-(4-methoxyphenyl)silane (PubChem CID 15514740) has the molecular formula C13H18Cl2OSi and a molecular weight of 289.28 g/mol. Its IUPAC name is dichloro-cyclohexyl-(4-methoxyphenyl)silane.

Molecular Properties

Compound Namedichloro-cyclohexyl-(4-methoxyphenyl)silane
PubChem CID15514740
Molecular FormulaC13H18Cl2OSi
Molecular Weight289.28 g/mol
Exact Mass288.05
IUPAC Namedichloro-cyclohexyl-(4-methoxyphenyl)silane
SMILESCOc1ccc([Si](Cl)(Cl)C2CCCCC2)cc1
InChIInChI=1S/C13H18Cl2OSi/c1-16-11-7-9-13(10-8-11)17(14,15)12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3
InChIKeyNJQKRNXPMGCQBL-UHFFFAOYSA-N
XLogP4.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.28
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

cyclohexyl-(4-methoxyphenoxy)-dimethylsilane
CID 532618
dichloro-bis(4-methoxyphenyl)silane
CID 15847326
trichloro-(4-methoxyphenyl)silane
CID 13219757
1-methoxy-4-[2-(4-methoxyphenyl)cyclohexyl]benzene
CID 101244821
1-cyclohexylsulfanyl-4-methoxybenzene
CID 13011159
N-(4-methoxyphenyl)cyclooctanamine
CID 29275692
(2R,3R)-2-cyclohexyl-3-(4-methoxyphenyl)oxirane
CID 11207019
bromomethane;1-cyclopentyl-4-methoxybenzene
CID 160663013
(7-methoxynaphthalen-2-yl) cyclohexanecarboxylate
CID 60592496
N-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine
CID 43633186
1-(1-cyclohexylethenyl)-4-methoxybenzene
CID 122206167
1-cyclohexyl-4-(4-methoxyphenyl)benzene;ethene
CID 144983864

Frequently Asked Questions

What is the IUPAC name of dichloro-cyclohexyl-(4-methoxyphenyl)silane?
The IUPAC name of dichloro-cyclohexyl-(4-methoxyphenyl)silane (CID 15514740) is dichloro-cyclohexyl-(4-methoxyphenyl)silane.
What is the SMILES notation for dichloro-cyclohexyl-(4-methoxyphenyl)silane?
The canonical SMILES for dichloro-cyclohexyl-(4-methoxyphenyl)silane is COc1ccc([Si](Cl)(Cl)C2CCCCC2)cc1.
What is the InChIKey of dichloro-cyclohexyl-(4-methoxyphenyl)silane?
The InChIKey is NJQKRNXPMGCQBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18Cl2OSi/c1-16-11-7-9-13(10-8-11)17(14,15)12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3.
What are the key properties of dichloro-cyclohexyl-(4-methoxyphenyl)silane?
dichloro-cyclohexyl-(4-methoxyphenyl)silane has a molecular weight of 289.28 g/mol, XLogP of 4.16, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-cyclohexyl-(4-methoxyphenyl)silane is sourced from PubChem (CID 15514740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).