bromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane

C11H23BrOSi — CID 91728796

IUPACbromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane
SMILESCCC1CCCCC1O[Si](C)(C)CBr
InChIInChI=1S/C11H23BrOSi/c1-4-10-7-5-6-8-11(10)13-14(2,3)9-12/h10-11H,4-9H2,1-3H3
InChIKeyILORMXSOIRITBN-UHFFFAOYSA-N
MW279.29 g/mol
LogP4.11
Rot. Bonds4

About bromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane

bromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane (PubChem CID 91728796) has the molecular formula C11H23BrOSi and a molecular weight of 279.29 g/mol. Its IUPAC name is bromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane.

Molecular Properties

Compound Namebromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane
PubChem CID91728796
Molecular FormulaC11H23BrOSi
Molecular Weight279.29 g/mol
Exact Mass278.07
IUPAC Namebromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane
SMILESCCC1CCCCC1O[Si](C)(C)CBr
InChIInChI=1S/C11H23BrOSi/c1-4-10-7-5-6-8-11(10)13-14(2,3)9-12/h10-11H,4-9H2,1-3H3
InChIKeyILORMXSOIRITBN-UHFFFAOYSA-N
XLogP4.11
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.29
LogP ≤ 54.11
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'}

Analyze bromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Cyclohexanol, 2-methyl, DMTBS
CID 529214
2-Methylcyclohexyl trimethylsilyl ether
CID 6432411
Cyclohexanemethanol, bromomethyldimethylsilyl ether
CID 91725776
trans-2-Methylcyclohexanol, bromomethyldimethylsilyl ether
CID 91725780
trans-4-Methylcyclohexanol, bromomethyldimethylsilyl ether
CID 91725781
Silane, trimethyl[(2-methylcyclohexyl)oxy]-
CID 520959
1-Trimethylsilyloxy-2-cyclohexylethane
CID 573407
1-Cyclohexylethanol, tert-butyldimethylsilyl ether
CID 15402227
1-Cyclohexylethanol, TMS derivative
CID 20821444
trimethyl-[3-[(1S,2R)-2-trimethylsilyloxycyclohexyl]propyl]silane
CID 135010087
1-Ethyl-1-(2-ethylcyclohexyloxy)-1-silacyclohexane
CID 542582
1-(2-Ethylcyclohexyl)oxy-1-methyl-1-silacyclobutane
CID 554126

Frequently Asked Questions

What is the IUPAC name of bromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane?
The IUPAC name of bromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane (CID 91728796) is bromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane.
What is the SMILES notation for bromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane?
The canonical SMILES for bromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane is CCC1CCCCC1O[Si](C)(C)CBr.
What is the InChIKey of bromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane?
The InChIKey is ILORMXSOIRITBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23BrOSi/c1-4-10-7-5-6-8-11(10)13-14(2,3)9-12/h10-11H,4-9H2,1-3H3.
What are the key properties of bromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane?
bromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane has a molecular weight of 279.29 g/mol, XLogP of 4.11, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bromomethyl-(2-ethylcyclohexyl)oxy-dimethylsilane is sourced from PubChem (CID 91728796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).