Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

Methyl N-(tert-butoxycarbonyl)glycinate

Related Products

Hot Products

Name

Methyl N-(tert-butoxycarbonyl)glycinate

EINECS N/A
CAS No. 31954-27-5 Density 1.072 g/cm3
PSA 64.63000 LogP 1.07500
Solubility N/A Melting Point N/A
Formula C8H15NO4 Boiling Point 266.8 °C at 760 mmHg
Molecular Weight 189.211 Flash Point 115.2 °C
Transport Information N/A Appearance N/A
Safety 24/25 Risk Codes N/A
Molecular Structure Molecular Structure of 31954-27-5 (BOC-GLY-OME) Hazard Symbols N/A
Synonyms

Glycine,N-carboxy-, N-tert-butyl methyl ester (6CI);(tert-Butoxycarbonylamino)aceticacid methyl ester;BOC-glycine methyl ester;MethylN-[[(1,1-dimethylethyl)oxy]carbonyl]glycinate;N-(Carbo-tert-butyloxy)glycinemethyl ester;N-(tert-Butoxycarbonyl)glycine methyl ester;N-Boc-glycine methylester;

Article Data 61

Methyl N-(tert-butoxycarbonyl)glycinate Specification

The Glycine,N-[(1,1-dimethylethoxy)carbonyl]-, methyl ester, with the CAS registry number 31954-27-5, has the systematic name of methyl N-(tert-butoxycarbonyl)glycinate. It belongs to the following product categories: Amino Acid Derivatives; Glycine; Peptide Synthesis; Miscellaneous. And the molecular formula of the chemical is C8H15NO4.

The characteristics of Glycine,N-[(1,1-dimethylethoxy)carbonyl]-, methyl ester are as followings: (1)ACD/LogP: 1.22; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.22; (4)ACD/LogD (pH 7.4): 1.22; (5)ACD/BCF (pH 5.5): 4.94; (6)ACD/BCF (pH 7.4): 4.94; (7)ACD/KOC (pH 5.5): 109.23; (8)ACD/KOC (pH 7.4): 109.21; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 55.84 Å2; (13)Index of Refraction: 1.437; (14)Molar Refractivity: 46.22 cm3; (15)Molar Volume: 176.4 cm3; (16)Polarizability: 18.32×10-24cm3; (17)Surface Tension: 33 dyne/cm; (18)Density: 1.072 g/cm3; (19)Flash Point: 115.2 °C; (20)Enthalpy of Vaporization: 50.48 kJ/mol; (21)Boiling Point: 266.8 °C at 760 mmHg; (22)Vapour Pressure: 0.00845 mmHg at 25°C.   

Preparation of Glycine,N-[(1,1-dimethylethoxy)carbonyl]-, methyl ester: This chemical can be prepared by carbonazidic acid tert-butyl ester and glycine methyl ester; hydrochloride. The reaction will need reagent N-methylmorpholine, and the menstruum ethyl acetate. And the yield is about 57%. 

Uses of Glycine,N-[(1,1-dimethylethoxy)carbonyl]-, methyl ester: It can be used to produce N-(tert-butoxycarbonyl)-2-aminoethanol. This reaction will need reagent anhydrous lithium chloride, sodium borohydride, and the menstruum tetrahydrofuran and ethanol. And the yield is about 70%.   

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(OC(C)(C)C)NCC(=O)OC
(2)InChI: InChI=1/C8H15NO4/c1-8(2,3)13-7(11)9-5-6(10)12-4/h5H2,1-4H3,(H,9,11)
(3)InChIKey: PHUZOEOLWIHIKH-UHFFFAOYAZ

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 31954-27-5