DL-Methionine methylsulfonium chloride

C6H14ClNO2SCAS 3493-12-7199.69 g/mol

Open in Covalent MOL file
S+NH2OO−HCl
Carboxylic acidPrimary 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 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
4

Hazards

Not classified as hazardous under GHS by 2 ECHA notifiers. Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Vitamin U1115-84-0Defined stereoisomer

Similar compounds

Zinc methionine sulfate56329-42-139 % similar Calcium L-aspartate21059-46-138 % similar Stachydrine chloride4136-37-236 % similar L-2,4-Diaminobutyric acid dihydrochloride1883-09-635 % similar 2,4-Diaminobutyric acid dihydrochloride65427-54-535 % similar L-Aspartic acid sodium salt monohydrate323194-76-934 % similar Methyl L-ornithine dihydrochloride40216-82-834 % similar (R)-(+)-Alpha-amino-gamma-butyrolactone hydrochloride104347-13-933 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Methionine methyl ester hydrochloride2491-18-1 H-D-Met-ome hcl69630-60-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook