CAS No.2817-13-2,Z-L-LEUCYL-L-ALANINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	2817-13-2
Name:	Z-L-LEUCYL-L-ALANINE
Article Data:	11

Formula:	C₁₇H₂₄N₂O₅
Molecular Weight:	336.388
Synonyms:	Z-Leu-Ala-OH;Alanine,N-(N-carboxy-L-leucyl)-, N-benzyl ester, L- (6CI,7CI,8CI);L-Alanine,N-[N-[(phenylmethoxy)carbonyl]-L-leucyl]-;N-(Benzyloxycarbonyl)-L-leucyl-L-alanine;N-(Benzyloxycarbonyl)leucylalanine;N-Benzoxycarbonyl-L-leucyl-L-alanine;NSC 333758;
EINECS:	220-571-1
Density:	1.181 g/cm³
Melting Point:	150-155 °C
Boiling Point:	581.7 °C at 760 mmHg
Flash Point:	305.6 °C
PSA:	104.73000
LogP:	2.69860

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Specification

The L-Alanine,N-[(phenylmethoxy)carbonyl]-L-leucyl-, with the CAS registry number 2817-13-2, is also known as N-(Benzyloxycarbonyl)-L-leucyl-L-alanine. Its EINECS number is 220-571-1. This chemical's molecular formula is C₁₇H₂₄N₂O₅ and formula weight is 336.38. What's more, its IUPAC name is 2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]propanoic acid. Its storage temperature is -20°C.

Physical properties of L-Alanine,N-[(phenylmethoxy)carbonyl]-L-leucyl- are: (1)ACD/LogP: 2.65; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.41; (4)ACD/BCF (pH 5.5): 1; (5)ACD/KOC (pH 5.5): 3.81; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 7; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 9; (10)Polar Surface Area: 76.15 Å²; (11)Index of Refraction: 1.529; (12)Molar Refractivity: 87.93 cm³; (13)Molar Volume: 284.8 cm³; (14)Surface Tension: 45.9 dyne/cm; (15)Density: 1.181 g/cm³; (16)Flash Point: 305.6 °C; (17)Enthalpy of Vaporization: 91.49 kJ/mol; (18)Boiling Point: 581.7 °C at 760 mmHg; (19)Vapour Pressure: 2.26E-14 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)CC(C)C)C
(2)InChI: InChI=1S/C17H24N2O5/c1-11(2)9-14(15(20)18-12(3)16(21)22)19-17(23)24-10-13-7-5-4-6-8-13/h4-8,11-12,14H,9-10H2,1-3H3,(H,18,20)(H,19,23)(H,21,22)/t12-,14-/m0/s1
(3)InChIKey: CWMXJBNCYBDNTJ-JSGCOSHPSA-N