Sodium methanetrisulfonate

CAT: 0127-OR1029009-01Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-OR1029009-01Size:25 g

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CAS Number

1393642-36-8

Synonyms

Trisodium; methanetrisulfonate

Purity

99%

Smiles

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

Chemical Information

Sodium methanetrisulfonate

CAS Number	1393642-36-8
PubChem CID	140592579
IUPAC Name	trisodium;methanetrisulfonate
Molecular Formula	CHNa3O9S3
Molecular Weight	322.2
Topological Polar Surface Area	197
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	0
Heavy Atom Count	16
Formal Charge	0
Complexity	340

SMILES

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

InChI

InChI=1S/CH4O9S3.3Na/c2-11(3,4)1(12(5,6)7)13(8,9)10;;;/h1H,(H,2,3,4)(H,5,6,7)(H,8,9,10);;;/q;3*+1/p-3

InChIKey

JWLDKEPWWPTYLJ-UHFFFAOYSA-K

Chemical Structure

2D Structure

CAS: 1393642-36-8

CID: 140592579

Formula: CHNa3O9S3

MW: 322.2

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	322.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	0
Exact Mass	321.84757797
Monoisotopic Mass	321.84757797
Topological Polar Surface Area	197 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	340
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	4
Compound Is Canonicalized	Yes

Catalog	Name
OR938724-01	Sodium methanethiosulfonate
IN3250	Sodium
OR1042867-01	Dikegulac sodium
OR1078904-01	Sodium Octanohydroxamate
OR1078862-01	Ozagrel Sodium
OR1078125	Bispyribac Sodium
PC109267-01	Pantoprazole sodium
PC109203-01	Sodium Perflurononyloxybenzenesulfonate
PC109083-01	Sodium Fluoromethanesulfinate
OR4292-01	Sodium cyanoborohydride

Catalog	Name
FT184306	Trisodium methanetrisulfonate
1191110 500	Sodium Metabisulphite (Sodium Disulphite, Sodium Pyrosulphite)
RM-T081600-01	Thiopental Sodium And Sodium Carbonate
21121001-100g	Sodium caprylate- (Sodium octanoate)
GTR19178128-01	Emlenoflast sodium (MCC7840 sodium)
AR-H01074-01	Nadroparin Sodium (Heparin Sodium)
31112-64	Sodium
030180-01	Sodium Metabisulphite (Sodium Disulphite, Sodium Pyrosulphite) 95.0%
85254-01	Cefoperazone Sodium (CFZ, Cefaperazone Sodium)
77969456	Sodium thiomethoxide (Sodium methyl mercaptide)