Boc-4-Amino-D-phenylalanine supplier

Name
Boc-4-Amino-D-phenylalanine
EINECS
CAS No. 164332-89-2
Article Data13
CAS DataBase
Density 1.213 g/cm³
Solubility
Melting Point 130-132°C
Formula C₁₄H₂₀N₂O₄
Boiling Point 484.9 °C at 760 mmHg
Molecular Weight 280.324
Flash Point 247 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 4-amino-N-(tert-butoxycarbonyl)-D-phenylalanine;(2R)-3-(4-Aminophenyl)-2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)propanoic acid;4-Amino-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-phenylalanine;D-Phenylalanine, 4-amino-N-[(1,1-dimethylethoxy)carbonyl]-;(2R)-3-(4-aminophenyl)-2-[(tert-butoxycarbonyl)amino]propanoic acid;3-(4-aminophenyl)-2-{[(tert-butoxy)carbonyl]amino}propanoic acid;4-Amino-D-phenylalanine, N-BOC protected;
PSA 101.65000
LogP 2.76130

Boc-4-Amino-D-phenylalanine Specification

The Boc-4-Amino-D-phenylalanine, with the CAS registry number 164332-89-2, has the systematic name of 4-amino-N-(tert-butoxycarbonyl)-D-phenylalanine. It belongs to the product categories: Phenylalanine analogs and other aromatic alpha amino acids; Amino Acids; Phenylalanine [Phe, F]; Unusual Amino Acids; Boc-Amino acid series; a-amino. And it should be stored at -15°C. The molecular formula of the chemical is C₁₄H₂₀N₂O₄.

The characteristics of Boc-4-Amino-D-phenylalanine are as followings: (1)ACD/LogP: 1.68; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.3; (4)ACD/LogD (pH 7.4): -1.8; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 2.05; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 6; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 59.08 Å²; (13)Index of Refraction: 1.56; (14)Molar Refractivity: 74.69 cm³; (15)Molar Volume: 230.9 cm³; (16)Polarizability: 29.61×10^-24cm³; (17)Surface Tension: 50.4 dyne/cm; (18)Density: 1.213 g/cm³; (19)Flash Point: 247 °C; (20)Enthalpy of Vaporization: 79.03 kJ/mol; (21)Boiling Point: 484.9 °C at 760 mmHg; (22)Vapour Pressure: 3.25E-10 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(OC(C)(C)C)N[C@@H](C(=O)O)Cc1ccc(N)cc1
(2)InChI: InChI=1/C14H20N2O4/c1-14(2,3)20-13(19)16-11(12(17)18)8-9-4-6-10(15)7-5-9/h4-7,11H,8,15H2,1-3H3,(H,16,19)(H,17,18)/t11-/m1/s1
(3)InChIKey: NDMVQEZKACRLDP-LLVKDONJBS

Product Name

Boc-4-Amino-D-phenylalanine

Boc-4-Amino-D-phenylalanine Specification

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