chempirical

L-Lysine acetate

C8H18N2O4CAS 57282-49-2206.24 g/mol

Open in Covalent MOL file
OOHH2NNH2OOH
Carboxylic acidPrimary amine

Properties

Molecular formula
C8H18N2O4
Molar mass
206.24 g/mol
Exact mass
206.1267 Da
logP
-0.38Crippen estimate
Polar surface area
126.6 Ų
H-bond donors / acceptors
4 / 4
Rotatable bonds
5
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
57282-49-2
SMILES
CC(=O)O.NCCCC[C@H](N)C(=O)O
InChIKey
RRNJROHIFSLGRA-JEDNCBNOSA-N
InChI
InChI=1S/C6H14N2O2.C2H4O2/c7-4-2-1-3-5(8)6(9)10;1-2(3)4/h5H,1-4,7-8H2,(H,9,10);1H3,(H,3,4)/t5-;/m0./s1

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

Names and synonyms

3 names
  • L-Lysine, acetate (1:1)
  • L-Lysine, monoacetate
  • Lysine monoacetate

Work with L-Lysine acetate

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

Ornithine acetate60259-81-691 % similar Polylysine25104-18-178 % similar L-Lysine56-87-178 % similar Lysine70-54-278 % similar D-Lysine923-27-378 % similar L-Lysine, hydrate (1:1)39665-12-874 % similar Lysine hydrochloride10098-89-271 % similar Poly(L-lysine) hydrobromide25988-63-071 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook