Name: CBZ-GLY HYDRAZIDE
SKU: 5680-83-1

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Basic Information

Molecular Structure:
CAS No.:	5680-83-1
Name:	CBZ-GLY HYDRAZIDE
Article Data:	19

Formula:	C₁₀H₁₃N₃O₃
Molecular Weight:	223.232
Synonyms:	Cbz-Glycine hydrazide;Benzyl (hydrazinocarbonylmethyl)carbamate;
EINECS:	227-141-2
Density:	1.259 g/cm³
Melting Point:	116-117 °C
Boiling Point:	491.6 °C at 760 mmHg
Flash Point:	251.1 °C
PSA:	93.45000
LogP:	1.38480

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Specification

The Benzyl N-(hydrazinecarbonylmethyl)carbamate, with the CAS registry number 5680-83-1, is also known as Glycine, N-[(phenylmethoxy)carbonyl]-, hydrazide. Its molecular formula is Glycine, N-[(phenylmethoxy)carbonyl]-, hydrazide and its molecular weight is 223.2285. Additionally, it has the systematic name benzyl (2-hydrazinyl-2-oxoethyl)carbamate (non-preferred name).

Other characteristics of the Benzyl N-(hydrazinecarbonylmethyl)carbamate can be summarised as followings: (1)ACD/LogP: 0.01; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.01; (4)ACD/LogD (pH 7.4): 0.01; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 24.2; (8)ACD/KOC (pH 7.4): 24.24; (9)#H bond acceptors: 6; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 53.09 Å²; (13)Index of Refraction: 1.563; (14)Molar Refractivity: 57.59 cm³; (15)Molar Volume: 177.1 cm³; (16)Polarizability: 22.83×10^-24cm³; (17)Surface Tension: 53 dyne/cm; (18)Density: 1.259 g/cm³; (19)Flash Point: 251.1 °C; (20)Enthalpy of Vaporization: 75.84 kJ/mol; (21)Boiling Point: 491.6 °C at 760 mmHg; (22)Vapour Pressure: 8.25E-10 mmHg at 25°C.

Production method of the Benzyl N-(hydrazinecarbonylmethyl)carbamate: It could be obtained by the reactant of N-benzyloxycarbonyl-glycine methyl ester. This reaction needs the reagent of NH₂NH₂, and the solvent of ethanol. The yield is 90 %.

the Benzyl N-(hydrazinecarbonylmethyl)carbamate could be obtained by the reactant of N-benzyloxycarbonyl-glycine methyl ester

Uses of the Benzyl N-(hydrazinecarbonylmethyl)carbamate: It could react with butane-2,3-dione to obtain the (5,6-dimethyl-[1,2,4]triazin-3-ylmethyl)-carbamic acid benzyl ester. This reaction needs the reagent of NH₄OAc, and the solvent of acetic acid. The yield is 40 %. In addition, this reaction should be taken by heating.

the Benzyl N-(hydrazinecarbonylmethyl)carbamate could react with butane-2,3-dione to obtain the (5,6-dimethyl-[1,2,4]triazin-3-ylmethyl)-carbamic acid benzyl ester

You can still convert the following datas into molecular structure:
1.SMILES: O=C(NN)CNC(=O)OCc1ccccc1
2.InChI: InChI=1/C10H13N3O3/c11-13-9(14)6-12-10(15)16-7-8-4-2-1-3-5-8/h1-5H,6-7,11H2,(H,12,15)(H,13,14)
3.InChIKey: FBXJOIKPPWLCJU-UHFFFAOYAP