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5891-53-2

Basic Information
CAS No.: 5891-53-2
Name: H-GLU-LYS-OH
Article Data: 3
Molecular Structure:
Molecular Structure of 5891-53-2 (H-GLU-LYS-OH)
Formula: C11H21N3O5
Molecular Weight: 275.3
Synonyms: GLU-LYS; H-Glu-Lys-OH; L-glutamic acid-L-lysine; GLUTAMIC ACID-LYSINE; 6-amino-2-(2-amino-4-carboxybutanamido)hexanoic acid; L-Glu-L-Lys-OH; 查看更多英文别名 收起
Density: 1.29 g/cm3
Melting Point: >150 °C (decomp)(Solv: methanol (67-56-1))
Boiling Point: 611.9 °C at 760 mmHg
Flash Point: 323.9 °C
PSA: 155.74000
LogP: 0.66840
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Specification

The Glutamic acid, with the CAS registry number 5891-53-2, is also known as (S)-6-Amino-2-((S)-2-amino-4-carboxy-butyrylamino)-hexanoic acid. This chemical's molecular formula is C11H21N3O5 and molecular weight is 275.30154. Its IUPAC name is called 6-amino-2-[(2-amino-5-hydroxy-5-oxopentanoyl)amino]hexanoic acid. Glutamic acid is one of the 20 proteinogenic amino acids, and its codons are GAA and GAG. It is a non-essential amino acid. In neuroscience, glutamate is an important neurotransmitter that plays a key role in long-term potentiation and is important for learning and memory.

Physical properties of Glutamic acid: (1)ACD/LogP: -1.63; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -4.14; (4)ACD/LogD (pH 7.4): -4.18; (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: 8; (10)#H bond donors: 7; (11)#Freely Rotating Bonds: 12; (12)Index of Refraction: 1.538; (13)Molar Refractivity: 66.75 cm3; (14)Molar Volume: 213.4 cm3; (15)Surface Tension: 62.1 dyne/cm; (16)Density: 1.29 g/cm3; (17)Flash Point: 323.9 °C; (18)Enthalpy of Vaporization: 99.18 kJ/mol; (19)Boiling Point: 611.9 °C at 760 mmHg; (20)Vapour Pressure: 1.51E-16 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C(CCN)CC(C(=O)O)NC(=O)C(CCC(=O)O)N
(2)InChI: InChI=1S/C11H21N3O5/c12-6-2-1-3-8(11(18)19)14-10(17)7(13)4-5-9(15)16/h7-8H,1-6,12-13H2,(H,14,17)(H,15,16)(H,18,19)
(3)InChIKey: BBBXWRGITSUJPB-UHFFFAOYSA-N