Name: VAL-TYR-VAL
SKU: 17355-22-5

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Basic Information

Molecular Structure:
CAS No.:	17355-22-5
Name:	VAL-TYR-VAL

Formula:	C₁₉H₂₉N₃O₅
Molecular Weight:	379.456
Synonyms:	L-Valine,N-(N-L-valyl-L-tyrosyl)-;Valine, N-(N-L-valyl-L-tyrosyl)- (7CI);Valine,N-(N-L-valyl-L-tyrosyl)-, L- (8CI);6: PN: WO2008106043 TABLE: 6 claimedprotein;L-Valyl-L-tyrosyl-L-valine;NSC 339922;Valyltyrosylvaline;H-Val-Tyr-Val crystalline;valine, valyltyrosyl-;Val-Tyr-Val;valyltyrosylvaline;
Density:	1.207 g/cm³
Boiling Point:	708 °C at 760 mmHg
Flash Point:	382 °C
PSA:	141.75000
LogP:	2.11030

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Specification

The L-Valine,L-valyl-L-tyrosyl-, with the CAS registry number 17355-22-5, has the systematic name of valyltyrosylvaline. It belongs to the following product categories: Dipeptides and Tripeptides; Peptides; Tripeptides. And the molecular formula of the chemical is C₁₉H₂₉N₃O₅. What's more, it should be stored at -20°C.

The characteristics of L-Valine,L-valyl-L-tyrosyl- are as followings: (1)ACD/LogP: 1.86; (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: 11; (10)Polar Surface Area: 79.39 Å²; (11)Index of Refraction: 1.554; (12)Molar Refractivity: 100.78 cm³; (13)Molar Volume: 314.3 cm³; (14)Polarizability: 39.95×10^-24cm³; (15)Surface Tension: 51 dyne/cm; (16)Density: 1.207 g/cm³; (17)Flash Point: 382 °C; (18)Enthalpy of Vaporization: 108.73 kJ/mol; (19)Boiling Point: 708 °C at 760 mmHg; (20)Vapour Pressure: 4.89E-21 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(O)C(NC(=O)C(NC(=O)C(N)C(C)C)Cc1ccc(O)cc1)C(C)C
(2)InChI: InChI=1/C19H29N3O5/c1-10(2)15(20)18(25)21-14(9-12-5-7-13(23)8-6-12)17(24)22-16(11(3)4)19(26)27/h5-8,10-11,14-16,23H,9,20H2,1-4H3,(H,21,25)(H,22,24)(H,26,27)
(3)InChIKey: ZNGPROMGGGFOAA-UHFFFAOYAA