CAS No.: 20301-63-7 — Phosphorodithioic acid, S-(2-(ethylsulfonyl)ethyl) O,O-dimethyl ester (久效威亚砜)

1. Primary Information

English name:	Phosphorodithioic acid, S-(2-(ethylsulfonyl)ethyl) O,O-dimethyl ester
CAS No.:	20301-63-7
Molecular formula:	C₆H₁₅O₄PS₃
Molecular weight:	278.4 g/mol
SMILES:	CCS(=O)(=O)CCSP(=S)(OC)OC
Structural class:
Other identifiers:	-

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	1ml	100ug/ml	1704	2-8°C	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 29 28 0 0 0 0 0 0 0999 V2000 -2.8679 -0.0062 0.1975 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1862 0.1463 -1.3605 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 -0.1937 -1.0860 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -0.0273 -0.1773 P 0 0 0 0 0 0 0 0 0 0 0 0 -2.8656 -1.3562 0.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8489 1.1434 1.0853 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9236 1.2099 0.8918 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6899 -1.2462 0.8822 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5131 0.1427 -0.9264 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2921 0.1513 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1874 0.0313 -0.1965 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5785 0.0490 -0.0665 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1094 2.5438 0.4484 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6214 -2.5881 0.4288 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6259 -0.6542 -1.6693 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 1.1138 -1.4232 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2269 1.1214 -1.3564 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2387 -0.6438 -1.6044 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1187 -0.9233 0.3347 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0857 0.8281 0.5473 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4415 0.1483 -0.7319 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6534 -0.9154 0.4462 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6417 0.8355 0.6923 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7251 3.2212 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5716 2.7260 -0.4849 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1751 2.7400 0.3073 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0938 -2.6550 -0.5256 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0811 -3.1789 1.1728 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6313 -2.9919 0.3235 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 3 4 2 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 7 13 1 0 0 0 0 8 14 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 11 19 1 0 0 0 0 11 20 1 0 0 0 0 12 21 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

2-ethylsulfonylethylsulfanyl-dimethoxy-sulfanylidene-λ5-phosphane

4.2 InChI

InChI=1S/C6H15O4PS3/c1-4-14(7,8)6-5-13-11(12,9-2)10-3/h4-6H2,1-3H3

4.3 InChIKey

GAXMYYJSILFZLT-UHFFFAOYSA-N

4.4 Canonical SMILES

CCS(=O)(=O)CCSP(=S)(OC)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)