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13726-84-6

Basic Information
CAS No.: 13726-84-6
Name: N-tert-Butoxycarbonyl-L-glutamic acid gamma-tert-butyl ester
Article Data: 1
Molecular Structure:
Molecular Structure of 13726-84-6 (N-tert-Butoxycarbonyl-L-glutamic acid gamma-tert-butyl ester)
Formula: C14H25NO6
Molecular Weight: 303.356
Synonyms: Glutamicacid, N-carboxy-, N,5-di-tert-butyl ester, L- (7CI,8CI);(2S)-5-tert-Butoxy-2-[(tert-butoxycarbonyl)amino]-5-oxopentanoic acid;(S)-5-tert-Butoxy-2-(tert-butoxycarbonylamino)-5-oxopentanoic acid;N-Boc-L-glutamic acid g-(tert-butyl)ester;N-Boc-glutaminic acid d-(tert-butyl)ester;N-tert-Butoxycarbonylglutamic acid g-tert-butyl ester;NSC 164048;
Density: 1.121 g/cm3
Melting Point: 102-105 °C
Boiling Point: 449.8 °C at 760 mmHg
Flash Point: 225.8 °C
Appearance: White to off-white microcrystalline powder
PSA: 101.93000
LogP: 2.47710
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  •  HANGZHOU TIANYE CHEMICALS CO., LTD.

     China (Mainland)  |  Contact Details

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    Tel:0571-85083592

    Address:1208# HuaCe Building-B,Wuchanggang Road,XIHU District,Hangzhou City,Zhejiang Province ,China

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  • Boc-Glu(OtBu)-OH

  • Casno:

    13726-84-6

    Boc-Glu(OtBu)-OH

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    good quality, competitive price, thoughtful after sale serviceAppearance:white powder Storage:Keep it in dry,shady and cool place Package:5g Application:Pharma;Industry;Agricultural;chemical reaserch Transportation:by express or by sea Port:Any port

    Shanghai Yuanye Bio-Technology Co., Ltd. is a comprehensive enterprise of life science, specializing in the research, development and sales of biochemical reagents, analytical stan

  •  Shanghai Yuanye Bio-Technology Co., Ltd.

    China (Mainland)  |  Contact Details

    Business Type:Trading Company

    Tel:+86-21-61845781

    Address:Building 6, No. 465, Changta Road,Songjiang District,Shanghai,China

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  • BOC-Glu(OtBu)

  • Casno:

    13726-84-6

    BOC-Glu(OtBu)

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    Stock products, own laboratory Package:Grams, Kilograms Application:For R&D Transportation:According to customer request Port:Shanghai

    We are a team of industry experts, dedicated to delivering the best chemical solutions from quality suppliers across China. Putting our customers first, we take a holistic approach

  •  Chemlyte Solutions

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    Business Type:Other

    Tel:+86-189 8945 5137

    Address:Jian Qiao Community, 789 Shenhua Road, Xihu District, Hangzhou, China, 310000

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Specification

The IUPAC name of Boc-Glu(OtBu)-OH is 5-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acid. With the CAS registry number 13726-84-6, it is also named as N-tert-Butoxycarbonyl-L-glutamic acid γ-tert-butyl ester. The product's categories are Amino Acid Derivatives; Amino Acids; Glutamic Acid [Glu, E]; Boc-Amino Acids and Derivative; Boc-Amino acid Series. It is white powder which is stable under normal temperature and pressure. Additionally, this chemical should be sealed in the container and stored in the ventilate, cool and dry place.

The other characteristics of Boc-Glu(OtBu)-OH can be summarized as: (1)ACD/LogP: 2.82; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.69; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 6.06; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 7; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 9; (11)Index of Refraction: 1.47; (12)Molar Refractivity: 75.5 cm3; (13)Molar Volume: 270.5 cm3; (14)Polarizability: 29.93×10-24 cm3; (15)Surface Tension: 38.9 dyne/cm; (16)Enthalpy of Vaporization: 77.66 kJ/mol; (17)Vapour Pressure: 2.42E-09 mmHg at 25°C; (18)Tautomer Count: 2; (19)Exact Mass: 303.168188; (20)MonoIsotopic Mass: 303.168188; (21)Topological Polar Surface Area: 102; (22)Heavy Atom Count: 21; (23)Complexity: 391.

People can use the following data to convert to the molecule structure. 
1. SMILES:O=C(OC(C)(C)C)N[C@H](C(=O)O)CCC(=O)OC(C)(C)C
2. InChI:InChI=1/C14H25NO6/c1-13(2,3)20-10(16)8-7-9(11(17)18)15-12(19)21-14(4,5)6/h9H,7-8H2,1-6H3,(H,15,19)(H,17,18)/t9-/m0/s1
3. InChIKey:YGSRAYJBEREVRB-VIFPVBQEBE