CAS No.: 1134-23-2 — Cycloate (草灭特)

1. Primary Information

English name:	Cycloate
CAS No.:	1134-23-2
Molecular formula:	C₁₁H₂₁NOS
Molecular weight:	215.36 g/mol
SMILES:	CCN(C1CCCCC1)C(=O)SCC
Structural class:
Other identifiers:	cycleate cycloate ethsane etsan Ro-neet

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	1.2ml	1000μg/ml in methylbenzene	312	2-8℃	in stock	-
Kehua Intelligence	1.2ml	100μg/ml in methylbenzene	152	2-8℃	in stock	-
Kehua Intelligence	1ml	1000μg/ml in methanol	312	2-8℃	in stock	-
Kehua Intelligence	50mg	99%	336	2-8℃	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 35 35 0 0 0 0 0 0 0999 V2000 -2.7748 0.2557 0.1907 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8016 -1.3924 -0.2663 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1235 0.7704 0.3264 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2963 0.5278 0.2393 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7261 -0.5423 1.2462 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6873 0.1386 -1.1884 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2162 -0.8537 1.1336 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1772 -0.1754 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6042 -1.2395 -0.2909 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5135 2.1307 0.7106 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0782 -0.2397 0.0584 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6798 3.0235 -0.5017 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6155 -1.2894 -0.2195 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1202 -1.1143 -0.1405 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8348 1.4530 0.4841 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1735 -1.4775 1.1072 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5017 -0.2040 2.2655 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4373 0.9525 -1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1315 -0.7379 -1.5379 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4765 -1.6671 1.8203 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7964 0.0238 1.4447 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7559 0.7409 -1.1276 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4095 -0.5143 -2.3139 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6880 -1.3896 -0.3502 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1339 -2.1960 -0.5502 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4265 2.1331 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2549 2.5455 1.3745 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2608 3.1123 -1.0553 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4341 2.6390 -1.1946 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9832 4.0288 -0.1931 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3349 -1.5995 -1.2312 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3026 -2.0719 0.4792 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4400 -0.8291 0.8675 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4747 -0.3554 -0.8464 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6186 -2.0567 -0.3908 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 13 1 0 0 0 0 2 11 2 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 15 1 0 0 0 0 5 7 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

S-ethyl N-cyclohexyl-N-ethylcarbamothioate

4.2 InChI

InChI=1S/C11H21NOS/c1-3-12(11(13)14-4-2)10-8-6-5-7-9-10/h10H,3-9H2,1-2H3

4.3 InChIKey

DFCAFRGABIXSDS-UHFFFAOYSA-N

4.4 Canonical SMILES

CCN(C1CCCCC1)C(=O)SCC

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)