Trimethylsulfoxonium iodide

CAT: 0926-FT16184-01Size: 0.25 kgDry Ice: NoHazardous: No

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CAT#:0926-FT16184-01Size:0.25 kg

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CAS Number

1774-47-6

MDL Number

MFCD00011899

Smiles

C[S+] (=O) (C) C.[I-]

Molecular Formula

C3H9IOS

Molecular Weight

220.07 g/mol

Controlled

Chemical Information

Sulfoxonium, trimethyl-, iodide (1:1)

CAS Number	1774-47-6
PubChem CID	74498
Molecular Formula	C3H9IOS
Molecular Weight	220.07
Topological Polar Surface Area	18.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	6
Formal Charge	0
Complexity	53

SMILES

C[S+](=O)(C)C.[I-]

InChI

InChI=1S/C3H9OS.HI/c1-5(2,3)4;/h1-3H3;1H/q+1;/p-1

InChIKey

BPLKQGGAXWRFOE-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 1774-47-6

CID: 74498

Formula: C3H9IOS

MW: 220.07

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	220.07
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	219.94188
Monoisotopic Mass	219.94188
Topological Polar Surface Area	18.1 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	53
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
FT61303	Trimethylsulfoxonium bromide
FT10681	Trimethylsulfoxonium chloride
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FC37898-01	Calcium iodide
FM63154-01	(+) -Magnoflorine iodide
FJ66094-01	Jatrorrhizine iodide
FI47007-01	Isopropyl iodide
AAA54166-01	Oxapropanium iodide
A-1050-01	Acetylcholine iodide
HAA16173-01	Thiocholine iodide

Catalog	Name
TRC-T797500-10G	Trimethylsulfoxonium Iodide
022487	Trimethylsulfoxonium-d9 Iodide
242498-01	Trimethylsulfoxonium iodide 98+%
39671-01	Trimethylsulfoxonium Iodide (TMSI) extrapure, 99%
OR1015354-01	Trimethylsulfoxonium Bromide
289790-01	Trimethylsulfoxonium chloride
MA-0228	Iodide
056195-01	Cuprous Iodide for Synthesis (Copper (I) Iodide)