CAS No.: 90982-32-4 — Chlorimuron-ethyl (-)

1. Primary Information

English name:	Chlorimuron-ethyl
CAS No.:	90982-32-4
Molecular formula:	C₁₅H₁₅ClN₄O₆S
Molecular weight:	414.8 g/mol
SMILES:	CCOC(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)Cl)OC
Structural class:
Other identifiers:	chlorimuron ethyl chlorimuron-ethyl ethyl-2-(((((4-chloro-6-methoxyprimidin-2-yl)amino)carbonyl)amino)sulfonyl)benzoate

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	1ml	100μg/ml in methanol	80	2-8℃	in stock	-
Kehua Intelligence	1.2ml	1000μg/ml in acetonitrile	208	2-8℃	in stock	-
Kehua Intelligence	1.2ml	100μg/ml in acetonitrile	80	2-8℃	in stock	-
Kehua Intelligence	100mg	99%	800	2-8℃	in stock	-
Kehua Intelligence	1.2ml	100μg/ml in acetonitrile	64	-20℃；避光	in stock	-
Kehua Intelligence	1.2ml	1000μg/ml in acetonitrile	166	-20℃；避光	in stock	-
Kehua Intelligence	1g	AR,98%	240	2-8℃	in stock	-
Kehua Intelligence	5g	AR,98%	880	2-8℃	in stock	-
Kehua Intelligence	25g	AR,98%	2880	2-8℃	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 42 43 0 0 0 0 0 0 0999 V2000 -5.7613 -2.5393 0.2674 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.3662 0.3563 -1.8492 S 0 0 0 0 0 0 0 0 0 0 0 0 1.9593 -1.9608 0.8380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1574 1.4979 -2.7275 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3508 -0.6555 -2.2008 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 -1.9915 0.1974 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3446 1.4394 -0.8447 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5156 2.3594 0.7067 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8605 -0.4113 -1.5685 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3504 -0.6676 -0.8793 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9287 0.8651 -0.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4721 -1.4716 -0.3113 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7656 0.9424 -0.2484 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1158 0.0664 0.7791 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7287 2.3165 -0.0112 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 0.5647 2.0437 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0424 2.8147 1.2534 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3925 1.9389 2.2807 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 -1.3746 0.5698 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3175 0.2348 -1.0655 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 -3.3804 0.6697 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6554 -0.4105 -0.3988 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4799 -3.8408 1.0112 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1815 1.0744 0.3701 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1229 0.0754 0.5106 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7082 -1.1907 0.1507 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5058 3.3481 0.5416 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4574 3.0246 -0.7886 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7034 -0.1074 2.8529 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -1.4351 -1.6585 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0129 3.8845 1.4387 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6362 2.3268 3.2655 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1693 -1.6398 -1.1127 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 -3.8655 1.3344 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1132 -3.6361 -0.3699 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -4.9248 0.9013 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2234 -3.5656 2.0394 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2547 -3.3564 0.3602 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1207 0.2782 0.8797 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2054 3.4310 -0.5083 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6406 3.1359 1.1787 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9236 4.3111 0.8499 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 9 1 0 0 0 0 2 13 1 0 0 0 0 3 19 1 0 0 0 0 3 21 1 0 0 0 0 6 19 2 0 0 0 0 7 20 2 0 0 0 0 8 24 1 0 0 0 0 8 27 1 0 0 0 0 9 20 1 0 0 0 0 9 30 1 0 0 0 0 10 20 1 0 0 0 0 10 22 1 0 0 0 0 10 33 1 0 0 0 0 11 22 2 0 0 0 0 11 24 1 0 0 0 0 12 22 1 0 0 0 0 12 26 2 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 14 16 2 0 0 0 0 14 19 1 0 0 0 0 15 17 1 0 0 0 0 15 28 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 21 23 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

ethyl 2-[(4-chloro-6-methoxypyrimidin-2-yl)carbamoylsulfamoyl]benzoate

4.2 InChI

InChI=1S/C15H15ClN4O6S/c1-3-26-13(21)9-6-4-5-7-10(9)27(23,24)20-15(22)19-14-17-11(16)8-12(18-14)25-2/h4-8H,3H2,1-2H3,(H2,17,18,19,20,22)

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)