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17343-07-6

Basic Information
CAS No.: 17343-07-6
Name: H-GLY-GLY-TYR-OH
Article Data: 1
Molecular Structure:
Molecular Structure of 17343-07-6 (H-GLY-GLY-TYR-OH)
Formula: C13H17N3O5
Molecular Weight: 295.295
Synonyms: Glycylglycyl-L-tyrosine;Tyrosine,N-(N-glycylglycyl)-, L- (8CI);Tyrosine, N-(N-glycylglycyl)- (6CI);L-Tyrosine,N-(N-glycylglycyl)-;Glycylglycyltyrosine;NSC 334194;
Density: 1.381 g/cm3
Boiling Point: 720.2 °C at 760 mmHg
Flash Point: 389.4 °C
Appearance: White to off white powder
PSA: 141.75000
LogP: 0.06110
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    L-Tyrosine,glycylglycyl- (2S) -2 - [[2 - [aminoacetyl] amino] acetyl] amino] -3- (4-hydroxyphenyl) propanoic acid CAS Number: 17343-07-6 Molecular formula: C13H17N3O5 Molecular weight: 295.29100 Exact quality: 295.11700 PSA: 141.750

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Specification

The L-Tyrosine,glycylglycyl- is an organic compound with the formula C13H17N3O5. The IUPAC name of this chemical is 2-[[2-[(2-aminoacetyl)amino]acetyl]amino]-3-(4-hydroxyphenyl)propanoic acid. With the CAS registry number 17343-07-6, it is also named as glycyl-glycyl-tyrosine. The product's category is Amino Acid Derivatives.

Physical properties about L-Tyrosine,glycylglycyl- are: (1)ACD/LogP: -0.59; (2)# of Rule of 5 Violations: 1 ; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 8; (8)#H bond donors: 6; (9)#Freely Rotating Bonds: 9; (10)Polar Surface Area: 79.39 Å2; (11)Index of Refraction: 1.6; (12)Molar Refractivity: 73.15 cm3; (13)Molar Volume: 213.7 cm3; (14)Polarizability: 29×10-24cm3; (15)Surface Tension: 67.2 dyne/cm; (16)Density: 1.381 g/cm3; (17)Flash Point: 389.4 °C; (18)Enthalpy of Vaporization: 110.46 kJ/mol; (19)Boiling Point: 720.2 °C at 760 mmHg; (20)Vapour Pressure: 9.02E-22 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(NCC(=O)NC(C(=O)O)Cc1ccc(O)cc1)CN
(2)InChI: InChI=1/C13H17N3O5/c14-6-11(18)15-7-12(19)16-10(13(20)21)5-8-1-3-9(17)4-2-8/h1-4,10,17H,5-7,14H2,(H,15,18)(H,16,19)(H,20,21)
(3)InChIKey: INLIXXRWNUKVCF-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C13H17N3O5/c14-6-11(18)15-7-12(19)16-10(13(20)21)5-8-1-3-9(17)4-2-8/h1-4,10,17H,5-7,14H2,(H,15,18)(H,16,19)(H,20,21)
(5)Std. InChIKey: INLIXXRWNUKVCF-UHFFFAOYSA-N