(2-iodocyclohexyl)oxy-trimethylsilane

C9H19IOSi — CID 12624041

IUPAC(2-iodocyclohexyl)oxy-trimethylsilane
SMILESC[Si](C)(C)OC1CCCCC1I
InChIInChI=1S/C9H19IOSi/c1-12(2,3)11-9-7-5-4-6-8(9)10/h8-9H,4-7H2,1-3H3
InChIKeyAEZXQTQGVUNMPZ-UHFFFAOYSA-N
MW298.24 g/mol
LogP3.58
Rot. Bonds2

About (2-iodocyclohexyl)oxy-trimethylsilane

(2-iodocyclohexyl)oxy-trimethylsilane (PubChem CID 12624041) has the molecular formula C9H19IOSi and a molecular weight of 298.24 g/mol. Its IUPAC name is (2-iodocyclohexyl)oxy-trimethylsilane.

Molecular Properties

Compound Name(2-iodocyclohexyl)oxy-trimethylsilane
PubChem CID12624041
Molecular FormulaC9H19IOSi
Molecular Weight298.24 g/mol
Exact Mass298.02
IUPAC Name(2-iodocyclohexyl)oxy-trimethylsilane
SMILESC[Si](C)(C)OC1CCCCC1I
InChIInChI=1S/C9H19IOSi/c1-12(2,3)11-9-7-5-4-6-8(9)10/h8-9H,4-7H2,1-3H3
InChIKeyAEZXQTQGVUNMPZ-UHFFFAOYSA-N
XLogP3.58
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.24
LogP ≤ 53.58
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'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze (2-iodocyclohexyl)oxy-trimethylsilane 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

(Cyclohexyloxy)trimethylsilane
CID 262864
Cyclohexanol, DMTBS
CID 529216
1-Iodo-2-trimethylsiloxycyclododecane
CID 12624042
Dimethylsilyloxycyclohexane
CID 6329285
Silane, (cyclohexyloxy)triethyl-
CID 11390260
Cyclohexyloxy-tri(propan-2-yl)silane
CID 12619130
Chloro(cyclohexyloxy)dimethylsilane
CID 14197919
Tert-butyl-(4-iodocyclohexyl)oxy-dimethylsilane
CID 19904713
6-Iodohexyl trimethylsilyl ether
CID 557912
Butyl(dimethyl)silyloxycyclohexane
CID 593797
1-Tripropylsilyloxycyclohexane
CID 611554
Tert-butyl-cyclohexyloxy-dimethylsilane;iodozinc(1+)
CID 54671613

Frequently Asked Questions

What is the IUPAC name of (2-iodocyclohexyl)oxy-trimethylsilane?
The IUPAC name of (2-iodocyclohexyl)oxy-trimethylsilane (CID 12624041) is (2-iodocyclohexyl)oxy-trimethylsilane.
What is the SMILES notation for (2-iodocyclohexyl)oxy-trimethylsilane?
The canonical SMILES for (2-iodocyclohexyl)oxy-trimethylsilane is C[Si](C)(C)OC1CCCCC1I.
What is the InChIKey of (2-iodocyclohexyl)oxy-trimethylsilane?
The InChIKey is AEZXQTQGVUNMPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19IOSi/c1-12(2,3)11-9-7-5-4-6-8(9)10/h8-9H,4-7H2,1-3H3.
What are the key properties of (2-iodocyclohexyl)oxy-trimethylsilane?
(2-iodocyclohexyl)oxy-trimethylsilane has a molecular weight of 298.24 g/mol, XLogP of 3.58, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-iodocyclohexyl)oxy-trimethylsilane is sourced from PubChem (CID 12624041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).