CAS No.: 2439-99-8 — Glyphosine (草甘二磷)

1. Primary Information

English name:	Glyphosine
CAS No.:	2439-99-8
Molecular formula:	C₄H₁₁NO₈P₂
Molecular weight:	263.08 g/mol
SMILES:	C(C(=O)O)N(CP(=O)(O)O)CP(=O)(O)O
Structural class:
Other identifiers:	glyphosphine N,N-bis(phosphonomethyl)glycine

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	10mg	96%	160	RT	in stock	-
Kehua Intelligence	5g	试剂级，95%	38	RT	in stock	-
Kehua Intelligence	25g	试剂级，95%	76	RT	in stock	-
Kehua Intelligence	100g	试剂级，95%	204	RT	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 26 25 0 0 0 0 0 0 0999 V2000 2.1667 1.1991 0.0156 P 0 0 0 0 0 0 0 0 0 0 0 0 -2.2786 0.9152 -0.0143 P 0 0 0 0 0 0 0 0 0 0 0 0 3.7197 0.9987 0.4264 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1922 0.9775 -1.5865 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9580 2.2846 0.5177 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9934 1.2432 -1.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 2.5018 0.4695 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1025 -0.3129 0.2338 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4487 -3.5259 0.7846 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1397 -2.7182 -1.3165 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0193 -0.2022 0.1881 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4063 -0.2860 0.6519 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6668 0.9617 0.7536 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6836 -1.4381 0.5527 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0112 -2.5984 -0.1046 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9555 -1.1342 0.2328 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4787 -0.3253 1.7446 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7325 0.9366 1.8459 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3435 1.9347 0.4185 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6558 -1.6094 0.1191 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7417 -1.5860 1.6373 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3609 1.7104 0.2154 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5601 1.6853 -2.1573 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8840 2.4840 0.2629 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 1.2558 -2.1997 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8839 -4.2835 0.3385 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 7 2 0 0 0 0 1 12 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 8 2 0 0 0 0 2 13 1 0 0 0 0 3 22 1 0 0 0 0 4 23 1 0 0 0 0 5 24 1 0 0 0 0 6 25 1 0 0 0 0 9 15 1 0 0 0 0 9 26 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 12 16 1 0 0 0 0 12 17 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 21 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

2-[bis(phosphonomethyl)amino]acetic acid

4.2 InChI

InChI=1S/C4H11NO8P2/c6-4(7)1-5(2-14(8,9)10)3-15(11,12)13/h1-3H2,(H,6,7)(H2,8,9,10)(H2,11,12,13)

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)

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)