CAS No.: 57-67-0 — Sulfaguanidine (-)

1. Primary Information

English name:	Sulfaguanidine
CAS No.:	57-67-0
Molecular formula:	C₇H₁₀N₄O₂S
Molecular weight:	214.25 g/mol
SMILES:	C1=CC(=CC=C1N)S(=O)(=O)N=C(N)N
Structural class:
Other identifiers:	Gastro Entericanis Biocanina Gastro-Entericanis Biocanina GastroEntericanis Biocanina Sulfaguanidine Sulphaguanidine

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	20mg	HPLC≥98%	80	2-8℃	in stock	-
Kehua Intelligence	100mg	HPLC≥98%	280	2-8℃	in stock	-
Kehua Intelligence	1ml	1000μg/ml in methanol	312	2-8℃	in stock	-
Kehua Intelligence	1ml	100μg/ml in methanol	152	2-8℃	in stock	-
Kehua Intelligence	1mg	CP:≥98%;IE:≥98%atomD	1456	2-8℃	in stock	-
Kehua Intelligence	10mg	CP:≥98%;IE:≥98%atomD	12320	2-8℃	in stock	-
Kehua Intelligence	25g	98%	24	2-8℃	in stock	-
Kehua Intelligence	100g	98%	36	2-8℃	in stock	-
Kehua Intelligence	500g	98%	116	2-8℃	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 24 24 0 0 0 0 0 0 0999 V2000 1.0661 0.7725 0.0091 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3527 1.4361 1.2772 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3065 1.4838 -1.2414 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8449 -0.6668 -0.0096 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6933 -0.7065 -0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9079 -1.8997 -0.0267 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9242 0.3820 0.0025 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6251 0.3385 0.0048 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3015 0.1804 -1.2049 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2999 0.1497 1.2109 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3274 -0.3549 -0.0026 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6525 -0.1662 -1.2086 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6511 -0.1969 1.2071 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1484 -0.7522 -0.0117 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7953 0.3136 -2.1569 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7917 0.2604 2.1647 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 -0.2884 -2.1578 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1656 -0.3430 2.1535 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1847 -0.8194 -0.8827 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1833 -0.8419 0.8682 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9214 -1.8647 -0.0274 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4724 -2.8155 -0.0383 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5356 1.3177 0.0141 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9366 0.3167 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 8 1 0 0 0 0 4 14 2 0 0 0 0 5 11 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 14 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 14 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 12 1 0 0 0 0 9 15 1 0 0 0 0 10 13 2 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 17 1 0 0 0 0 13 18 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

2-(4-aminophenyl)sulfonylguanidine

4.2 InChI

InChI=1S/C7H10N4O2S/c8-5-1-3-6(4-2-5)14(12,13)11-7(9)10/h1-4H,8H2,(H4,9,10,11)

4.3 InChIKey

BRBKOPJOKNSWSG-UHFFFAOYSA-N

4.4 Canonical SMILES

C1=CC(=CC=C1N)S(=O)(=O)N=C(N)N

4.5 Isomeric SMILES

4.6 SDF file

Coming soon

5. Spectroscopic data

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

5.2 ¹H nuclear magnetic resonance (¹H NMR)

5.3 Mass spectrometry (MS)

Coming soon

5.4 Infrared spectroscopy (IR)

Coming soon

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

Coming soon

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)