CAS No.53308-95-5,BOC-NVA-OH Suppliers

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Basic Information

Molecular Structure:
CAS No.:	53308-95-5
Name:	BOC-NVA-OH
Article Data:	6

Formula:	C₁₀H₁₉NO₄
Molecular Weight:	217.265
Synonyms:	(2S)-2-[(tert-Butyloxycarbonyl)amino]pentanoicacid;(S)-2-(((tert-Butoxy)carbonyl)amino)-pentanoic acid;(S)-N-Boc-norvaline;BOC-L-Norvaline;N-BOC-(S)-norvaline;N-tert-Butoxycarbonyl-L-norvaline;NSC186911;(S)-2-[(tert-Butoxycarbonyl)amino]pentanoic acid;
EINECS:	1533716-785-6
Density:	1.081 g/cm³
Melting Point:	43-47 °C
Boiling Point:	348.306 °C at 760 mmHg
Flash Point:	164.45 °C
Appearance:	transparent solid
Safety:	24/25
PSA:	75.63000
LogP:	2.15530

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Specification

The Boc-L-Norvaline, with the CAS registry number 53308-95-5, is also known as (S)-2-[(tert-Butoxycarbonyl)amino]pentanoic acid. It belongs to the product categories of Aliphatics; Carboxylic Acids; API intermediates; Amino Acids; Norvaline [Nva]; Peptide; Carboxylic Acids. Its EINECS number is 203-479-6. This chemical's molecular formula is C₁₀H₁₉NO₄ and molecular weight is 217.26. What's more, its systematic name is N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-L-norvaline. When using it, you must avoid contact with skin and eyes. This chemical should be sealed and stored at the temperature of 0 - 6 °C.

Physical properties of Boc-L-Norvaline are: (1)ACD/LogP: 2.163; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.25; (4)ACD/LogD (pH 7.4): -1.32; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 4.38; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 75.63 Å²; (13)Index of Refraction: 1.462 ; (14)Molar Refractivity: 55.236 cm³; (15)Molar Volume: 200.952 cm³; (16)Polarizability: 21.897×10^-24cm³; (17)Surface Tension: 37.4 dyne/cm; (18)Density: 1.081 g/cm³; (19)Flash Point: 164.45 °C; (20)Enthalpy of Vaporization: 65.122 kJ/mol; (21)Boiling Point: 348.306 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(C)(C)C)N[C@H](C(=O)O)CCC
(2)Std. InChI: InChI=1S/C10H19NO4/c1-5-6-7(8(12)13)11-9(14)15-10(2,3)4/h7H,5-6H2,1-4H3,(H,11,14)(H,12,13)/t7-/m0/s1
(3)Std. InChIKey: INWOAUUPYIXDHN-ZETCQYMHSA-N