Dl-methionine methylsulfonium chloride

C₆H₁₄ClNO₂SCAS 3493-12-7199.69 g/mol

Open in Covalent MOL file

Carboxylic acid Primary amine

Properties

Molecular formula: C₆H₁₄ClNO₂S
Molar mass: 199.69 g/mol
Exact mass: 199.0434 Da
Melting point: 137–138 °C (decomposes)
logP: -1.25Crippen estimate
Polar surface area: 66.2 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 4

Identifiers

CAS number

3493-12-7

SMILES

C[S+](C)CCC(N)C(=O)[O-].Cl

InChIKey

MYGVPKMVGSXPCQ-UHFFFAOYSA-N

InChI

InChI=1S/C6H13NO2S.ClH/c1-10(2)4-3-5(7)6(8)9;/h5H,3-4,7H2,1-2H3;1H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names

Sulfonium, (3-amino-3-carboxypropyl)dimethyl-, chloride (1:1)
Sulfonium, (3-amino-3-carboxypropyl)dimethyl-, chloride, DL-
Sulfonium, (3-amino-3-carboxypropyl)dimethyl-, chloride, (±)-
Sulfonium, (3-amino-3-carboxypropyl)dimethyl-, chloride
Dl-Methionine methylsulphonium chloride
γ-Dimethylsulfonium-α-aminobutyric acid chloride
(3-Amino-3-carboxypropyl)dimethylsulfonium chloride
(3-Amino-3-carboxypropyl)dimethylsulfanium chloride

Work with Dl-methionine methylsulfonium chloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Zinc methionine sulfate56329-42-139 % similar Magnesium hydrogen aspartate2068-80-638 % similar Calcium L-aspartate21059-46-138 % similar Aspartic acid calcium salt (2:1)39162-75-938 % similar Cadabine hydrochloride4136-37-236 % similar Magnesium aspartate tetrahydrate7018-07-736 % similar L-2,4-Diaminobutyric acid dihydrochloride1883-09-635 % similar 2,4-Diaminobutyric acid dihydrochloride65427-54-535 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Vitamin U1115-84-0 Methionine methyl ester hydrochloride2491-18-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook