chloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane

C11H23ClOSi — CID 554804

IUPACchloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane
SMILESCC1CCC(O[Si](C)(C)CCl)CC1C
InChIInChI=1S/C11H23ClOSi/c1-9-5-6-11(7-10(9)2)13-14(3,4)8-12/h9-11H,5-8H2,1-4H3
InChIKeyADPJJFDRZYFKAN-UHFFFAOYSA-N
MW234.84 g/mol
LogP3.81
Rot. Bonds3

About chloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane

chloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane (PubChem CID 554804) has the molecular formula C11H23ClOSi and a molecular weight of 234.84 g/mol. Its IUPAC name is chloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane.

Molecular Properties

Compound Namechloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane
PubChem CID554804
Molecular FormulaC11H23ClOSi
Molecular Weight234.84 g/mol
Exact Mass234.12
IUPAC Namechloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane
SMILESCC1CCC(O[Si](C)(C)CCl)CC1C
InChIInChI=1S/C11H23ClOSi/c1-9-5-6-11(7-10(9)2)13-14(3,4)8-12/h9-11H,5-8H2,1-4H3
InChIKeyADPJJFDRZYFKAN-UHFFFAOYSA-N
XLogP3.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.84
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Trimethyl-(4-propan-2-ylcyclohexyl)oxysilane
CID 155681770
Chloromethylmenthoxy-silane
CID 129807699
3,4-Dimethyl-1-dimethylsilyloxycyclohexane
CID 175672769
1-Trimethylsilyloxy-3,4-dimethylcyclohexane
CID 554698
2-Ethyl-1-(dimethyl(chloromethyl)silyloxy)cyclohexane
CID 554801
3,5-Dimethyl-1-(dimethyl(chloromethyl)silyloxy)cyclohexane
CID 554802
1-Methyl-1-(3,4-dimethylcyclohexyloxy)-1-silacyclohexane
CID 575444
3,4-Dimethyl-1-dimethyl(trimethylsilylmethyl) silyloxycyclohexane
CID 589970
3,4-Dimethyl-1-pentamethyldisilyloxycyclohexane
CID 590063
3,4-Dimethyl-1-methyl(tetramethylene)silyloxycyclohexane
CID 598017
(4-Butan-2-ylcyclohexyl)oxy-trimethylsilane
CID 53784761
4-(Chloromethoxy)-1,2-dimethylcyclohexane
CID 79529605

Frequently Asked Questions

What is the IUPAC name of chloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane?
The IUPAC name of chloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane (CID 554804) is chloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane.
What is the SMILES notation for chloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane?
The canonical SMILES for chloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane is CC1CCC(O[Si](C)(C)CCl)CC1C.
What is the InChIKey of chloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane?
The InChIKey is ADPJJFDRZYFKAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23ClOSi/c1-9-5-6-11(7-10(9)2)13-14(3,4)8-12/h9-11H,5-8H2,1-4H3.
What are the key properties of chloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane?
chloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane has a molecular weight of 234.84 g/mol, XLogP of 3.81, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloromethyl-(3,4-dimethylcyclohexyl)oxy-dimethylsilane is sourced from PubChem (CID 554804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).