CAS No.35305-74-9,N-Acetyl-L-glutamine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	35305-74-9
Name:	N-Acetyl-L-glutamine
Article Data:	1

Formula:	C₇H₁₂N₂O₄
Molecular Weight:	188.183
Synonyms:	Ac-Gln-OH;
EINECS:	219-647-7
Density:	1.29 g/cm³
Melting Point:	206-208 °C
Boiling Point:	604.9 °C at 760 mmHg
Flash Point:	319.6 °C
Appearance:	white crystalline powder
Safety:	22-24/25
PSA:	109.49000
LogP:	-0.06760

Synthetic route

: 60218-18-0
2-(4-aminophenyl)-4-hydroxy-5-pyrimidine carboxylic acid

: 35305-74-9
N-acetyl-L-glutamine

: 543-27-1
isobutyl chloroformate

: 76718-77-9
2-[4-(N-acetyl-DL-glutaminylamino)phenyl]-4-hydroxy-5-pyrimidine carboxylic acid

Conditions

Conditions	Yield
With 4-methyl-morpholine; triethylamine In N-methyl-acetamide; water
With 4-methyl-morpholine; triethylamine In N-methyl-acetamide; water

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Specification

1. Introduction of N-Acetyl-L-glutamine

N-Acetyl-L-glutamine, with the IUPAC name of (2S)-2-acetamido-5-amino-5-oxopentanoic acid, is one kind of white crystalline powder. The product's categories are Amino Acids; Pharmaceutical Intermediates. Besides, it is white crystalline powder, which should be stored at 2-8 °C.

2. Properties of N-Acetyl-L-glutamine

The other characteristics of N-Acetyl-L-glutamine can be summarized as: (1) ACD/LogP: -2.06; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 4.37; (4) ACD/LogD (pH 7.4): -5.68; (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: 6; (10) #H bond donors: 4; (11) #Freely Rotating Bonds: 5; (12) Polar Surface Area: 66.92 Å²; (13) Index of Refraction: 1.504; (14) Molar Refractivity: 43.19 cm³; (15) Molar Volume: 145.8 cm³; (16) Surface Tension: 54.9 dyne/cm; (17) Density: 1.29 g/cm³; (18) Flash Point: 319.6 °C; (19) Enthalpy of Vaporization: 98.22 kJ/mol; (20) Boiling Point: 604.9 °C at 760 mmHg; (21) Vapour Pressure: 3.42E-16 mmHg at 25 °C; (22) Melting Point: 206-208 °C.

3. Structure Descriptors of N-Acetyl-L-glutamine

You could convert the following datas into the molecular structure:
(1) SMILES: O=C(N[C@H](C(=O)O)CCC(=O)N)C
(2) InChI: InChI=1/C7H12N2O4/c1-4(10)9-5(7(12)13)2-3-6(8)11/h5H,2-3H2,1H3,(H2,8,11)(H,9,10)(H,12,13)/t5-/m0/s1
(3) InChIKey: KSMRODHGGIIXDV-YFKPBYRVBV

4. Preparation and Uses of N-Acetyl-L-glutamine

N-Acetyl-L-glutamine can be prepared by the reaction of L-Glutamine with Acetic anhydride. Additionally, this chemical is used for biochemical research. And it can be used for the treatment of hepatic coma, brain tumors, paralysis and hypophrenia, memory disorders and other diseases.

5. Safety information of N-Acetyl-L-glutamine

Safety Statements: 22-24/25
WGK Germany: 3
When you are using this chemical, please be cautious about it as the following: the gas of this chemical can not be breathed. In addition, you should avoid contacting with skin and eyes.