L-Methionine O-ethyl ester hydrochloride

C7H16ClNO2SCAS 2899-36-7213.72 g/mol

Open in Covalent MOL file
OONH2SHCl
EsterPrimary amineSulfide

Properties

Molecular formula
C7H16ClNO2S
Molar mass
213.72 g/mol
Exact mass
213.0590 Da
Melting point
85–88 °C
logP
1.05Crippen estimate
Polar surface area
52.3 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
5
Stereocentres
Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
2899-36-7
SMILES
CCOC(=O)[C@@H](N)CCSC.Cl
InChIKey
KPWCQEUBJAIORR-RGMNGODLSA-N
InChI
InChI=1S/C7H15NO2S.ClH/c1-3-10-7(9)6(8)4-5-11-2;/h6H,3-5,8H2,1-2H3;1H/t6-;/m0./s1

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Names and synonyms

8 names
  • L-Methionine, ethyl ester, hydrochloride (1:1)
  • L-Methionine, ethyl ester, hydrochloride
  • Methionine, ethyl ester, hydrochloride, L-
  • Methionine ethyl ester hydrochloride
  • S-Methionine ethyl ester hydrochloride
  • Ethyl methioninate hydrochloride
  • Ethyl L-methioninate hydrochloride
  • Ethyl L-methionate hydrochloride

Work with L-Methionine O-ethyl ester hydrochloride

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.

H-D-Met-oet hcl7512-43-8Enantiomer

Similar compounds

L-Norvaline, ethyl ester, hydrochloride (1:1)40918-51-269 % similar Methionine methyl ester hydrochloride2491-18-168 % similar H-D-Met-ome hcl69630-60-068 % similar Diethyl L-glutamate hydrochloride1118-89-464 % similar (S)-Ethyl 2,5-diaminopentanoate dihydrochloride84772-29-264 % similar L-Methionine isopropyl ester hydrochloride85391-05-564 % similar Ethyl L-lysinate dihydrochloride3844-53-963 % similar L-Seryl ethyl ester hydrochloride26348-61-861 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

S-tert-Butyl-L-cysteine hydrochloride2481-09-6 3-Chloro-propane-1-sulfonic acid tert-butylamide63132-85-4

Elsewhere

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