Methyl L-ornithine dihydrochloride

C₆H₁₆Cl₂N₂O₂CAS 40216-82-8219.11 g/mol

Open in Covalent MOL file

Ester Primary amine

Properties

Molecular formula: C₆H₁₆Cl₂N₂O₂
Molar mass: 219.11 g/mol
Exact mass: 218.0589 Da
logP: 0.07Crippen estimate
Polar surface area: 78.3 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 4
Stereocentres: Sin SMILES atom order

Hazards

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

Identifiers

CAS number

40216-82-8

SMILES

COC(=O)[C@@H](N)CCCN.Cl.Cl

InChIKey

SNFZNVWAQDVFAK-XRIGFGBMSA-N

InChI

InChI=1S/C6H14N2O2.2ClH/c1-10-6(9)5(8)3-2-4-7;;/h5H,2-4,7-8H2,1H3;2*1H/t5-;;/m0../s1

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Names and synonyms

4 names

L-Ornithine, methyl ester, hydrochloride (1:2)
L-Ornithine, methyl ester, dihydrochloride
Ornithine, methyl ester, dihydrochloride, L-
(S)-Methyl 2,5-diaminopentanoate dihydrochloride

Work with Methyl L-ornithine dihydrochloride

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

Methyl L-lysinate dihydrochloride26348-70-991 % similar D-Lysine methyl ester dihydrochloride67396-08-191 % similar L-Glutamine methyl ester hydrochloride32668-14-769 % similar D-Glutamine methyl ester hydrochloride74817-54-269 % similar (S)-Ethyl 2,5-diaminopentanoate dihydrochloride84772-29-268 % similar (S)-Methyl 2-aminobutanoate hydrochloride56545-22-365 % similar Methyl D-homoalaninate hcl85774-09-065 % similar H-D-Arg-ome 2hcl78851-84-063 % similar

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

Same formula

Lysine dihydrochloride657-26-1

Elsewhere

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