trimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane

C6H12F3IO3Si — CID 87933422

IUPACtrimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane
SMILESCO[Si](OC)(OC)C(I)C(F)C(F)F
InChIInChI=1S/C6H12F3IO3Si/c1-11-14(12-2,13-3)6(10)4(7)5(8)9/h4-6H,1-3H3
InChIKeyQVDCHFRQVGMCFR-UHFFFAOYSA-N
MW344.14 g/mol
LogP1.81
Rot. Bonds6

About trimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane

trimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane (PubChem CID 87933422) has the molecular formula C6H12F3IO3Si and a molecular weight of 344.14 g/mol. Its IUPAC name is trimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane.

Molecular Properties

Compound Nametrimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane
PubChem CID87933422
Molecular FormulaC6H12F3IO3Si
Molecular Weight344.14 g/mol
Exact Mass343.96
IUPAC Nametrimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane
SMILESCO[Si](OC)(OC)C(I)C(F)C(F)F
InChIInChI=1S/C6H12F3IO3Si/c1-11-14(12-2,13-3)6(10)4(7)5(8)9/h4-6H,1-3H3
InChIKeyQVDCHFRQVGMCFR-UHFFFAOYSA-N
XLogP1.81
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.14
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 trimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane?
The IUPAC name of trimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane (CID 87933422) is trimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane.
What is the SMILES notation for trimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane?
The canonical SMILES for trimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane is CO[Si](OC)(OC)C(I)C(F)C(F)F.
What is the InChIKey of trimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane?
The InChIKey is QVDCHFRQVGMCFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12F3IO3Si/c1-11-14(12-2,13-3)6(10)4(7)5(8)9/h4-6H,1-3H3.
What are the key properties of trimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane?
trimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane has a molecular weight of 344.14 g/mol, XLogP of 1.81, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy-(2,3,3-trifluoro-1-iodopropyl)silane is sourced from PubChem (CID 87933422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).