CAS No.: 139-13-9 — - (氨三乙酸)

1. Primary Information

English name:	-
CAS No.:	139-13-9
Molecular formula:	-
Molecular weight:	- g/mol
SMILES:	-
Structural class:
Other identifiers:	Acid, Nitrilotriacetic Aluminum Nitrilotriacetate Dysprosium Nitrilotriacetate Nitrilotriacetate, Aluminum Nitrilotriacetate, Dysprosium

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	100mg	99%	504	2-8℃	in stock	-
Kehua Intelligence	100g	AR，98.5%	28	2-8℃	in stock	-
Kehua Intelligence	250g	AR，98.5%	38	2-8℃	in stock	-
Kehua Intelligence	500g	AR，98.5%	72	2-8℃	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 22 21 0 0 0 0 0 0 0999 V2000 0.5825 -3.2122 -0.9112 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 1.1308 -0.8893 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5012 2.1111 -0.9038 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6508 -2.5598 1.2641 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5632 0.6831 1.2758 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9286 1.8085 1.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0074 0.0065 0.0107 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0302 -0.9131 -0.4548 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3209 -0.4187 -0.4714 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2824 1.3701 -0.4314 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -2.2881 0.0725 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3615 0.5165 0.0796 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6382 1.7654 0.0852 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 -0.6711 -0.0805 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0863 -0.9395 -1.5505 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6083 -1.4182 -0.1265 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3688 -0.4234 -1.5678 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4193 2.1120 -0.0344 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2672 1.4526 -1.5257 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4017 -4.1061 -0.5498 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 1.7236 -0.5129 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3745 2.3825 -0.5489 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 20 1 0 0 0 0 2 12 1 0 0 0 0 2 21 1 0 0 0 0 3 13 1 0 0 0 0 3 22 1 0 0 0 0 4 11 2 0 0 0 0 5 12 2 0 0 0 0 6 13 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 8 11 1 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 9 12 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 10 13 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

2-[bis(carboxymethyl)amino]acetic acid

4.2 InChI

InChI=1S/C6H9NO6/c8-4(9)1-7(2-5(10)11)3-6(12)13/h1-3H2,(H,8,9)(H,10,11)(H,12,13)

4.3 InChIKey

MGFYIUFZLHCRTH-UHFFFAOYSA-N

4.4 Canonical SMILES

C(C(=O)O)N(CC(=O)O)CC(=O)O

4.5 Isomeric SMILES

4.6 SDF file

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5. Spectroscopic data

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

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5.2 ¹H nuclear magnetic resonance (¹H NMR)

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5.3 Mass spectrometry (MS)

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5.4 Infrared spectroscopy (IR)

Coming soon

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

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1. Primary Information

2. Suppliers & Pricing

3. Structures

3.1 2D structure

3.2 3D structure

4. International Nomenclature & Identifiers

4.1 IUPAC Name

4.2 InChI

4.3 InChIKey

4.4 Canonical SMILES

4.5 Isomeric SMILES

4.6 SDF file

5. Spectroscopic data

5.1 13C nuclear magnetic resonance (13C NMR)

5.2 1H nuclear magnetic resonance (1H NMR)

5.3 Mass spectrometry (MS)

5.4 Infrared spectroscopy (IR)

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

5.2 ¹H nuclear magnetic resonance (¹H NMR)