(3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane

C8H17ISi — CID 11065429

IUPAC(3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane
SMILESC[C@H]1C[Si](C)(C)C[C@@H]1CI
InChIInChI=1S/C8H17ISi/c1-7-5-10(2,3)6-8(7)4-9/h7-8H,4-6H2,1-3H3/t7-,8-/m0/s1
InChIKeyUFGCMMPLAXQFJW-YUMQZZPRSA-N
MW268.21 g/mol
LogP3.40
Rot. Bonds1

About (3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane

(3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane (PubChem CID 11065429) has the molecular formula C8H17ISi and a molecular weight of 268.21 g/mol. Its IUPAC name is (3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane.

Molecular Properties

Compound Name(3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane
PubChem CID11065429
Molecular FormulaC8H17ISi
Molecular Weight268.21 g/mol
Exact Mass268.01
IUPAC Name(3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane
SMILESC[C@H]1C[Si](C)(C)C[C@@H]1CI
InChIInChI=1S/C8H17ISi/c1-7-5-10(2,3)6-8(7)4-9/h7-8H,4-6H2,1-3H3/t7-,8-/m0/s1
InChIKeyUFGCMMPLAXQFJW-YUMQZZPRSA-N
XLogP3.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.21
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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'}

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Frequently Asked Questions

What is the IUPAC name of (3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane?
The IUPAC name of (3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane (CID 11065429) is (3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane.
What is the SMILES notation for (3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane?
The canonical SMILES for (3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane is C[C@H]1C[Si](C)(C)C[C@@H]1CI.
What is the InChIKey of (3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane?
The InChIKey is UFGCMMPLAXQFJW-YUMQZZPRSA-N. The full InChI is InChI=1S/C8H17ISi/c1-7-5-10(2,3)6-8(7)4-9/h7-8H,4-6H2,1-3H3/t7-,8-/m0/s1.
What are the key properties of (3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane?
(3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane has a molecular weight of 268.21 g/mol, XLogP of 3.40, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-3-(iodomethyl)-1,1,4-trimethylsilolane is sourced from PubChem (CID 11065429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).