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537-55-3

Basic Information
CAS No.: 537-55-3
Name: N-Acetyl-L-tyrosine
Article Data: 54
Molecular Structure:
Molecular Structure of 537-55-3 (N-Acetyl-L-tyrosine)
Formula: C11H13NO4
Molecular Weight: 223.229
Synonyms: (2S)-2-acetamido-3-(4-hydroxyphenyl)propanoic acid;Tyrosine, N-acetyl-, L- (8CI);L-Tyrosine, N-acetyl-;Tyrosine, N-acetyl-, L-;N-Acetyltyrosine (VAN);Acetyl-L-Tyrosine;Ac-Tyr-OH;
EINECS: 208-671-3
Density: 1.304 g/cm3
Melting Point: 149-152 °C(lit.)
Boiling Point: 531.3 °C at 760 mmHg
Flash Point: 275.1 °C
Solubility: Soluble in water (25 mg/ml), and ethanol.
Appearance: solid
Hazard Symbols: Xi
Risk Codes: 41-36/37/38
Safety: 26-39-36
PSA: 86.63000
LogP: 0.91490
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Specification

1. Introduction of N-Acetyl-L-tyrosine

N-Acetyl-L-tyrosine, with the IUPAC Name of 2-Acetamido-3-(4-hydroxyphenyl)propanoic acid, is being stable in normal condition while incompatible with strong oxidizing agents. When comes to its application, it is used in pharmaceutical industry. This chemical belongs to the Product Categories which include Amino Acid Derivatives; Amino Acids; Tyrosine [Tyr, Y];Ac-Amino Acids; Amino Acids (N-Protected); Biochemistry; Nutritional Supplements; Pharmaceutical Intermediates; N-Acetyl-Amino acid series; Amino acids; Biochemicals Found in Plants; Nutrition Research; Pharmacopoeial Amino AcidsPeptide Synthesis; Amino Acid Derivatives; Amino acidsPharmacopoeia (USP); Pharmacopoeia A-ZPharmacopoeia (USP); Tyrosine.

2. Properties of N-Acetyl-L-tyrosine

N-Acetyl-L-tyrosine has the following property datas: (1)XLogP3: -0.2; (2)H-Bond Donor: 3; (3)H-Bond Acceptor: 4; (4)EINECS: 208-671-3; (5)Melting Point: 149-152 °C(lit.); (6)Storage temp.: 2-8°C; (7)Surface Tension: 57 dyne/cm; (8)Density: 1.304 g/cm3; (9)Flash Point: 275.1 °C; (10)Enthalpy of Vaporization: 84.92 kJ/mol; (11)Boiling Point: 531.3 °C at 760 mmHg; (12)Vapour Pressure: 4.07E-12 mmHg at 25°C.

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

You could convert the following datas into the molecular structure:
InChI: InChI=1S/C11H13NO4/c1-7(13)12-10(11(15)16)6-8-2-4-9(14)5-3-8/h2-5,10,14H,6H2,1H3,(H,12,13)(H,15,16)/t10-/m0/s1 
InChIKey: InChIKey=CAHKINHBCWCHCF-JTQLQIEISA-N 
Smiles: c1cc(O)ccc1C[C@@H](C(=O)O)NC(=O)C

4. Safety Information of N-Acetyl-L-tyrosine
Hazard Codes: IrritantXi
Risk Statements: 41-36/37/38 
R41:Risk of serious damage to the eyes. 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-39-36 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S39:Wear eye / face protection. 
S36:Wear suitable protective clothing.
WGK Germany: 3
F: 10