CAS No.: 9041-37-6 — Methyl 1-acetyl-1H-thieno[3,2-c]pyrazole-5-carboxylate (葡聚糖凝胶LH-20)

1. Primary Information

English name:	Methyl 1-acetyl-1H-thieno[3,2-c]pyrazole-5-carboxylate
CAS No.:	9041-37-6
Molecular formula:	C₉H₈N₂O₃S
Molecular weight:	224.24 g/mol
SMILES:	CC(=O)N1C2=C(C=N1)SC(=C2)C(=O)OC
Structural class:
Other identifiers:	sephadex sephadex G sephadex G 10 sephadex G 100 sephadex G 15

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	25g	分离中等大小生物分子，球蛋白分离范围100～4000	400	RT	in stock	-
Kehua Intelligence	100g	分离中等大小生物分子，球蛋白分离范围100～4000	1360	RT	in stock	-
Kehua Intelligence	500g	分离中等大小生物分子，球蛋白分离范围100～4000	5440	RT	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 23 24 0 0 0 0 0 0 0999 V2000 -1.0397 -2.0353 -0.0008 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1705 1.2689 0.0013 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0812 2.2911 -0.0022 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8338 -0.9354 -0.0019 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1418 0.0255 0.0006 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9048 -1.1102 0.0015 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7636 -0.1886 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6104 -1.5476 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4661 0.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5156 -0.3779 -0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9459 -2.0495 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7658 1.2782 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9149 -0.0846 -0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2659 1.2561 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5387 1.6903 0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5682 1.5962 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2528 -3.0862 0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6434 0.7612 -0.8989 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6427 0.7626 0.9002 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6351 2.2865 -0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5591 2.7832 0.0038 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0434 1.3257 0.9017 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0440 1.3282 -0.8978 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 10 1 0 0 0 0 2 13 1 0 0 0 0 2 15 1 0 0 0 0 3 12 2 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 13 1 0 0 0 0 11 17 1 0 0 0 0 12 14 1 0 0 0 0 14 18 1 0 0 0 0 14 19 1 0 0 0 0 14 20 1 0 0 0 0 15 21 1 0 0 0 0 15 22 1 0 0 0 0 15 23 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

methyl 1-acetylthieno[3,2-c]pyrazole-5-carboxylate

4.2 InChI

InChI=1S/C9H8N2O3S/c1-5(12)11-6-3-7(9(13)14-2)15-8(6)4-10-11/h3-4H,1-2H3

4.3 InChIKey

XELZGAJCZANUQH-UHFFFAOYSA-N

4.4 Canonical SMILES

CC(=O)N1C2=C(C=N1)SC(=C2)C(=O)OC

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)