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CAS No.: | 13504-85-3 |
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Name: | N-Cbz-Hydroxy-L-proline |
Article Data: | 75 |
Molecular Structure: | |
Formula: | C13H15NO5 |
Molecular Weight: | 265.266 |
Synonyms: | (2S,4R)-1-(Benzyloxycarbonyl)-4-hydroxyproline;(2S,4R)-4-Hydroxypyrrolidine-1,2-dicarboxylic acid 1-benzyl ester;1-(Benzyloxycarbonyl)-trans-4-hydroxy-(S)-proline;N-(Benzyloxycarbonyl)-trans-4-Hydroxy-D-proline;N-Carbobenzoxy-4-hydroxy-L-proline;Z-Hyp-OH;1,2-Pyrrolidinedicarboxylic acid, 4-hydroxy-, 1-benzyl ester, L-trans-(6CI,8CI); |
EINECS: | 236-831-2 |
Density: | 1.416 g/cm3 |
Melting Point: | 104-107 °C |
Boiling Point: | 486.9 °C at 760 mmHg |
Flash Point: | 248.3 °C |
Solubility: | Slightly soluble in water. |
Appearance: | White fine crystalline powder |
PSA: | 87.07000 |
LogP: | 0.78090 |
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The IUPAC name of N-Cbz-Hydroxy-L-proline is 4-hydroxy-1-phenylmethoxycarbonylpyrrolidine-2-carboxylic acid . With the CAS registry number 13504-85-3, it is also named as 1-Benzyl hydrogen (2S-trans)-4-hydroxypyrrolidine-1,2-dicarboxylate ; (4R)-1-[(Benzyloxy)carbonyl]-4-hydroxy-L-proline ; 1,2-Pyrrolidinedicarboxylic acid, 4-hydroxy-, 1-(phenylmethyl) ester, (2S,4R)- ; Z-Hyp-OH ; Z-L-4-Hydroxyproline .
The N-Cbz-Hydroxy-L-proline is white fine crystalline powder which should be stored at RT.. The product's categories are hydroxyproline [Hyp], unusual amino acids and Z-amino acid series. This product can be used as pharmaceutical intermediates. It also can be used to prepare other chemicals.
The other characteristics of this product can be summarized as: (1)ACD/LogP: -0.10 ; (2)# of Rule of 5 Violations: 0 ; (3)ACD/LogD (pH 5.5): -1.82 ; (4)ACD/LogD (pH 7.4): -3.48 ; (5)ACD/BCF (pH 5.5): 1 ; (6)ACD/BCF (pH 7.4): 1 ; (7)ACD/KOC (pH 5.5): 1 ; (8)ACD/KOC (pH 7.4): 1 ; (9)#H bond acceptors: 6 ; (10)#H bond donors: 2 ; (11)#Freely Rotating Bonds: 5 ; (12)Index of Refraction: 1.612 ; (13)Molar Refractivity: 65.14 cm3 ; (14)Molar Volume: 187.3 cm3 ; (15)Polarizability: 25.82×10-24 cm3 ; (16)Surface Tension: 69.8 dyne/cm ; (17)Enthalpy of Vaporization: 79.28 kJ/mol ; (18)Vapour Pressure: 2.71E-10 mmHg at 25°C.
People can use the following data to convert to the molecule structure. SMILES: O[C@@H]1C[C@@H](C(O)=O)N(C1)C(=O)OCc2ccccc2; InChI: InChI=1/C13H15NO5/c15-10-6-11(12(16)17)14(7-10)13(18)19-8-9-4-2-1-3-5-9/h1-5,10-11,15H,6-8H2,(H,16,17)/t10-,11+/m1/s1.
The N-Cbz-Hydroxy-L-proline has many suppliers, such as GL Biochem (Shanghai) Ltd., Nanjing Panfeng Chemical Co., Ltd., Shanghai Demo Chemical Co., Ltd., Shanghai Dere Finechem Co., Ltd., Sichuan Emei Ronggao Biochemicals Co., Ltd., Sichuan Tongsheng Amino Acids Co., Ltd. and Yangzhou Baosheng Bio-Chemical Co., Ltd..