CAS No.5262-39-5,N-OXALYL GLYCINE Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	5262-39-5
Name:	N-OXALYL GLYCINE
Article Data:	1

Formula:	C₄H₅NO₅
Molecular Weight:	147.087
Synonyms:	N-Oxaloglycine;Oxamicacid, (carboxymethyl)- (7CI,8CI);N-Oxalylglycine;Oxalylglycine;
Density:	1.638 g/cm³
Appearance:	colourless solid
Hazard Symbols:	Xi
Risk Codes:	22
PSA:	103.70000
LogP:	-1.33730

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Specification

The Glycine, N-(carboxycarbonyl)-, with the CAS registry number 5262-39-5, is also known as N-Oxalyl glycine.This chemical is used as an inhibitor of α-ketoglutarate-dependent enzymes. It belongs to the product categories of Bio-material; None; Other. This chemical's molecular formula is C₄H₅NO₅ and molecular weight is 147.09. What's more, its IUPAC name is 2-(Carboxymethylamino)-2-oxoacetic acid. In addition, it must be stored in airtight containers and placed in a dry, cool place. In addition, this chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about Glycine, N-(carboxycarbonyl)- are: (1)ACD/LogP: -1.61; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -6.33; (4)ACD/LogD (pH 7.4): -6.35; (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: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 72.91 Å²; (13)Index of Refraction: 1.521; (14)Molar Refractivity: 27.33 cm³; (15)Molar Volume: 89.7 cm³; (16)Polarizability: 10.83×10^-24 cm³; (17)Surface Tension: 79.3 dyne/cm; (18)Density: 1.638 g/cm³.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)C(=O)NCC(=O)O
(2) InChI: InChI=1/C4H5NO5/c6-2(7)1-5-3(8)4(9)10/h1H2,(H,5,8)(H,6,7)(H,9,10)
(3) InChIKey: BIMZLRFONYSTPT-UHFFFAOYAM