ChemicalBook--->CAS DataBase List--->2949-92-0

2949-92-0

2949-92-0 Structure

2949-92-0 Structure
IdentificationMore
[Name]

S-Methyl methanethiolsulfonate
[CAS]

2949-92-0
[Synonyms]

METHANETHIOSULFONIC ACID S-METHYL ESTER
METHYL METHANETHIOLSULFONATE
METHYL METHANETHIOSULFONATE
MMTS
S-METHYL METHANETHIOLSULFONATE
S-METHYL METHANETHIONSULFONATE
S-METHYL METHANETHIOSULFONATE
S-METHYL METHANETHIOSULPHONATE
S-METHYL THIOMETHANESULFONATE
dimethyl thiosulfonate
Methanesulfonic acid, thio-, S-methyl ester
Methanesulfonothioic acid, S-methyl ester
methanesulfonothioicacid,s-methylester
Methyl methanesulfonothioate
methylmethanesulfonothioate
S-Methyl methanesulfonothioate
S-methyl methylthiosulfonate
s-methylmethanesulfonothioate
thio-methanesulfonicacis-methylester
S-Methyl thiomethanesuphonate
[EINECS(EC#)]

220-970-0
[Molecular Formula]

C2H6O2S2
[MDL Number]

MFCD00007565
[Molecular Weight]

126.2
[MOL File]

2949-92-0.mol
Chemical PropertiesBack Directory
[Appearance]

Light Yellow Liquid
[Melting point ]

117.0-119.0 °C
[Boiling point ]

69-71 °C0.4 mm Hg(lit.)
[density ]

1.337 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.513(lit.)
[Fp ]

190 °F
[storage temp. ]

2-8°C
[solubility ]

chloroform: soluble750mg + 5 ml Chloroformmg/mL, colorless to light greenish-yellow
[form ]

clear liquid
[color ]

Colorless to Red to Green
[Odor]

at 0.10 % in propylene glycol. sulfurous pungent roasted
[Odor Type]

sulfurous
[Usage]

Used for the rapid and selective modification of sulfhydryl groups of enzymes. Useful for mapping the pore-lining regions of the ryanodine receptor.
[BRN ]

1446059
[Stability:]

Water Sensitive
[Major Application]

cleaning products
cosmetics
flavors and fragrances
food and beverages
personal care
[InChI]

1S/C2H6O2S2/c1-5-6(2,3)4/h1-2H3
[InChIKey]

XYONNSVDNIRXKZ-UHFFFAOYSA-N
[SMILES]

CSS(C)(=O)=O
[LogP]

0.247 (est)
[CAS DataBase Reference]

2949-92-0(CAS DataBase Reference)
[NIST Chemistry Reference]

S-methyl methanethiosulphonate(2949-92-0)
[EPA Substance Registry System]

2949-92-0(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)Exclamation Mark (GHS07)
GHS06,GHS07
[Signal word ]

Danger
[Hazard statements ]

H227-H301+H311+H331-H315-H319
[Precautionary statements ]

P210-P261-P264-P270-P271-P280-P301+P310+P330-P302+P352+P312+P361+P364-P304+P340+P311-P305+P351+P338+P337+P313-P403+P233-P405-P501
[Hazard Codes ]

Xi
[Risk Statements ]

R36:Irritating to the eyes.
R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

3334
[WGK Germany ]

2
[RTECS ]

PB2765000
[F ]

13
[TSCA ]

TSCA listed
[HazardClass ]

IRRITANT
[PackingGroup ]

III
[HS Code ]

29309090
[Storage Class]

10 - Combustible liquids
[Toxicity]

mouse,LD50,intraperitoneal,9110ug/kg (9.11mg/kg),Toxicology and Applied Pharmacology. Vol. 72, Pg. 513, 1984.
Hazard InformationBack Directory
[Chemical Properties]

Light Yellow Liquid
[Uses]

S-Methyl methanethiosulfonate was used as sulfenylating agent for β-keto sulfoxides, methylene compounds, half-esters of malonic acids and aryl Grignard reagents. It was also used as a reagent to trap the natural thiol-disulfide state of the proteins.
[Uses]

carbonyl reactive homobifunctional cross-linking reagent cleavable with periodate
[Uses]

S-Methyl methanethiolsulfonate is used for the rapid and selective modification of sulfhydryl groups of enzymes and it is also useful for mapping the pore-lining regions of the ryanodine receptor.
[Definition]

ChEBI: A sulfonic acid derivative obtained by condensaton of methanesulfonic acid with methanethiol.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 49, p. 2281, 1984 DOI: 10.1021/jo00186a039
Synthetic Communications, 20, p. 365, 1990 DOI: 10.1080/00397919008052777
[General Description]

Interaction of S-methyl methanethiosulfonate (MMTS) with dipalmitoylphosphatidylcholine (DPPC) bilayers has been investigated by FTIR and surface-enhanced Raman spectroscopy.
[Purification Methods]

Purify it by fractional distillation under reduced pressure, IR: 1350, 750 cm-1 . [Applegate et al. J Org Chem 38 943 1973, Beilstein 4 IV 31.]
Spectrum DetailBack Directory
[Spectrum Detail]

S-Methyl methanethiolsulfonate(2949-92-0)MS
S-Methyl methanethiolsulfonate(2949-92-0)1HNMR
S-Methyl methanethiolsulfonate(2949-92-0)13CNMR
S-Methyl methanethiolsulfonate(2949-92-0)IR1
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

S-Methyl methanethiolsulfonate, 97%(2949-92-0)
[Sigma Aldrich]

2949-92-0(sigmaaldrich)
[TCI AMERICA]

S-Methyl Methanethiosulfonate,>95.0%(GC)(2949-92-0)
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