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

Hazards

Not classified as hazardous under GHS by 8 ECHA notifiers. Aggregated from 8 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

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

Weigh it out

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

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.

Acetic acid64-19-7Free acid (2H3)Acetic (2H)acid1186-52-3Free acid, labelled Lysine70-54-2Free base, stereo not defined Polylysine25104-18-1Free base L-Lysine56-87-1Free base D-Lysine923-27-3Free base, enantiomer Potassium acetate127-08-2Salt Aluminium diacetate142-03-0Salt Calcium acetate62-54-4Salt Copper(II) acetate142-71-2Salt Mercury(II) acetate1600-27-7Salt Lead(II) acetate301-04-2Salt

Similar compounds

Ornithine70-26-870 % similar DL-ornithine hydrochloride1069-31-464 % similar (R)-Ornithine hydrochloride16682-12-564 % similar Ornithine hydrochloride3184-13-264 % similar Ornithine dihydrochloride6211-16-164 % similar L-2,4-Diaminobutyric acid1758-80-159 % similar D-2,4-Diaminobutyric acid26908-94-159 % similar Diaminopimelic acid583-93-758 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook