bis(4-methylcyclohexyl)-dipropoxysilane

C20H40O2Si — CID 139675628

IUPACbis(4-methylcyclohexyl)-dipropoxysilane
SMILESCCCO[Si](OCCC)(C1CCC(C)CC1)C1CCC(C)CC1
InChIInChI=1S/C20H40O2Si/c1-5-15-21-23(22-16-6-2,19-11-7-17(3)8-12-19)20-13-9-18(4)10-14-20/h17-20H,5-16H2,1-4H3
InChIKeyATUHHFHIUHOFQS-UHFFFAOYSA-N
MW340.62 g/mol
LogP6.44
Rot. Bonds8

About bis(4-methylcyclohexyl)-dipropoxysilane

bis(4-methylcyclohexyl)-dipropoxysilane (PubChem CID 139675628) has the molecular formula C20H40O2Si and a molecular weight of 340.62 g/mol. Its IUPAC name is bis(4-methylcyclohexyl)-dipropoxysilane.

Molecular Properties

Compound Namebis(4-methylcyclohexyl)-dipropoxysilane
PubChem CID139675628
Molecular FormulaC20H40O2Si
Molecular Weight340.62 g/mol
Exact Mass340.28
IUPAC Namebis(4-methylcyclohexyl)-dipropoxysilane
SMILESCCCO[Si](OCCC)(C1CCC(C)CC1)C1CCC(C)CC1
InChIInChI=1S/C20H40O2Si/c1-5-15-21-23(22-16-6-2,19-11-7-17(3)8-12-19)20-13-9-18(4)10-14-20/h17-20H,5-16H2,1-4H3
InChIKeyATUHHFHIUHOFQS-UHFFFAOYSA-N
XLogP6.44
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.62
LogP ≤ 56.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

cyclononyl-cyclopropyl-diethoxysilane
CID 139768397
cyclobutyl-diethoxy-(3-methylcyclobutyl)silane
CID 139843913
butoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane
CID 141248696
bis(1,4-dimethylcyclohexane);methane;propane
CID 159253657
cycloheptyl-hydroxy-dipropoxysilane
CID 57088742
tributoxy(cyclopropyl)silane
CID 139991761
1-methyl-4-[(4-propoxycyclohexyl)oxymethyl]cyclohexane
CID 137428589
1,4-dimethylcyclohexane;ethane;methane;propane
CID 143683179
cyclohexyl-(iodomethyl)-dipropoxysilane
CID 23146620
dicyclopentyl dipropyl silicate
CID 175030171
butane;methylcyclopentane
CID 142053859
N-(cyclopropylmethyl)-1-(4-methylcyclohexyl)methanamine
CID 63001385

Frequently Asked Questions

What is the IUPAC name of bis(4-methylcyclohexyl)-dipropoxysilane?
The IUPAC name of bis(4-methylcyclohexyl)-dipropoxysilane (CID 139675628) is bis(4-methylcyclohexyl)-dipropoxysilane.
What is the SMILES notation for bis(4-methylcyclohexyl)-dipropoxysilane?
The canonical SMILES for bis(4-methylcyclohexyl)-dipropoxysilane is CCCO[Si](OCCC)(C1CCC(C)CC1)C1CCC(C)CC1.
What is the InChIKey of bis(4-methylcyclohexyl)-dipropoxysilane?
The InChIKey is ATUHHFHIUHOFQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40O2Si/c1-5-15-21-23(22-16-6-2,19-11-7-17(3)8-12-19)20-13-9-18(4)10-14-20/h17-20H,5-16H2,1-4H3.
What are the key properties of bis(4-methylcyclohexyl)-dipropoxysilane?
bis(4-methylcyclohexyl)-dipropoxysilane has a molecular weight of 340.62 g/mol, XLogP of 6.44, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-methylcyclohexyl)-dipropoxysilane is sourced from PubChem (CID 139675628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).