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4896-77-9

Basic Information
CAS No.: 4896-77-9
Name: GLYCINE-D5
Article Data: 5
Molecular Structure:
Molecular Structure of 4896-77-9 (GLYCINE-D5)
Formula: C2D5NO2
Molecular Weight: 80.0275
Synonyms: Glycine-d5(6CI,7CI,8CI,9CI);Aminoacetic acid-d5;Deuterated glycine;
EINECS: 225-518-6
Density: 1.338 g/cm3
Melting Point: 240 °C (dec.)(lit.)
Boiling Point: 240.9 °C at 760 mmHg
Flash Point: 99.5 °C
Appearance: White powder
Safety: 24/25
PSA: 63.32000
LogP: -0.27000
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Specification

The CAS register number of Glycine-N,N,1,2,2-d5 is 4896-77-9. It also can be called as Aminoacetic acid-d5 and the systematic name about this chemical is (2H5)glycine. The molecular formula about this chemical is C2D5NO2 and the molecular weight is 80.1. It belongs to the following product categories which include Amino Acids 13C, 2H, 15N; Alphabetical Listings; Amino Acids; Amino AcidsStable Isotopes; Biomolecular NMR; Buffers and ReagentsStable Isotopes; G-HStable Isotopes; Metabolic Research; NMR - Buffers and Reagents; NMR Solvents and Reagents; Stable Isotopes and so on.

Physical properties about Glycine-N,N,1,2,2-d5 are: (1)ACD/LogP: -1.03; (2)ACD/LogD (pH 5.5): -3.53; (3)ACD/LogD (pH 7.4): -3.53; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 29.54 Å2; (12)Index of Refraction: 1.46; (13)Molar Refractivity: 16.41 cm3; (14)Molar Volume: 59.8 cm3; (15)Polarizability: 6.5x10-24cm3; (16)Surface Tension: 54.4 dyne/cm; (17)Density: 1.338 g/cm3; (18)Flash Point: 99.5 °C; (19)Enthalpy of Vaporization: 52.63 kJ/mol; (20)Boiling Point: 240.9 °C at 760 mmHg; (21)Vapour Pressure: 0.0123 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
If you want to use this chemical, avoid contact with skin and eyes. It is stable under normal temperature and pressure. If you want to store it, you should keep the container tightly sealed in dry, cool places, usally protected by N2, and avoid contact with water, incompatible material, heat source and moist air. It can react with strong oxidizer.

You can still convert the following datas into molecular structure:
(1)SMILES: [2H]C([2H])(N([2H])[2H])C(=O)O[2H]
(2)InChI: InChI=1/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)/i1D2/hD3
(3)InChIKey: DHMQDGOQFOQNFH-LGLHGEJLEJ
(4)Std. InChI: InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)/i1D2/hD3
(5)Std. InChIKey: DHMQDGOQFOQNFH-LGLHGEJLSA-N