Basic information
- Name:
L-Lysine L-glutamate
- CAS No.:
5408-52-6
- Molecular Structure:
- Formula:
- C6H14N2O2·C5H9NO4
- Molecular Weight:
- 293.32
- Synonyms:
- Glutamic acid, L-, compd. with L-lysine (1:1);L-Lysine L-Glutamate Dihydrate;2-Aminopentanedioic acid; 2,6-diaminohexanoic acid;L-Glutamic acid, compd. with L-lysine (1:1);Lysine glutamate;L-Lysine ●L-glutamic acid;L-Lysine-L-Glutamate;L-Lysine L-glutamate 2-hydrate;L-Lysine-L-glutamic acid;L-Lys-L-Glu;L-Lysine-L- glutamate;
- EINECS:
- 226-474-0
- Boiling Point:
- 311.5 °C at 760 mmHg
- Flash Point:
- 142.2 °C
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Specification
The L-Lysine L-glutamate, with the CAS registry number 5408-52-6, is also known as Lys-Glu. Its EINECS registry number is 226-474-0. This chemical's molecular formula is C6H14N2O2·C5H9NO4 and molecular weight is 293.32. What's more, its IUPAC name is 2-Aminopentanedioic acid - 2,6-diaminohexanoic acid and systematic name is called L-Glutamic acid - L-lysine (1:1).
Physical properties about L-Lysine L-glutamate are: (1) ACD/LogP: -1.04; (2) # of Rule of 5 Violations: 1; (3) ACD/LogD (pH 5.5): -4.54; (4) ACD/LogD (pH 7.4): -4.5; (5) ACD/BCF (pH 5.5): 1; (6) ACD/BCF (pH 7.4): 1; (7) ACD/KOC (pH 5.5): 1; (8) ACD/KOC (pH 7.4): 1; (9) #H bond acceptors: 4; (10) #H bond donors: 5; (11) #Freely Rotating Bonds: 7; (12) Polar Surface Area: 32.78 Å2; (13) Flash Point: 142.2 °C; (14) Enthalpy of Vaporization: 60.75 kJ/mol; (15) Boiling Point: 311.5 °C at 760 mmHg; (16) Vapour Pressure: 0.000123 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)CC[C@H](N)C(=O)O.O=C(O)[C@@H](N)CCCCN
(2) InChI: InChI=1/C6H14N2O2.C5H9NO4/c7-4-2-1-3-5(8)6(9)10;6-3(5(9)10)1-2-4(7)8/h5H,1-4,7-8H2,(H,9,10);3H,1-2,6H2,(H,7,8)(H,9,10)/t5-;3-/m00/s1
(3) InChIKey: HOMROMWVNDUGRI-RVZXSAGBBJ