CAS No.: 3761-42-0 — Fenthion sulfone (倍硫磷-砜)

1. Primary Information

English name:	Fenthion sulfone
CAS No.:	3761-42-0
Molecular formula:	C₁₀H₁₅O₅PS₂
Molecular weight:	310.3 g/mol
SMILES:	CC1=C(C=CC(=C1)OP(=S)(OC)OC)S(=O)(=O)C
Structural class:
Other identifiers:	-

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	1ml	100μg/ml in acetone	152	2-8℃	in stock	-
Kehua Intelligence	1ml	1000μg/ml in acetone	464	2-8℃	in stock	-
Kehua Intelligence	1ml	1000µg/ml in methylbenzene	832	2-8℃	in stock	-
Kehua Intelligence	1.2ml	100µg/ml in methylbenzene	152	2-8℃	in stock	-
Kehua Intelligence	1.2ml	1000µg/ml in methanol	464	2-8℃	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 33 33 0 0 0 0 0 0 0999 V2000 -3.8562 -0.5637 0.0178 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0066 -0.5344 2.1572 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1068 -0.1250 0.2530 P 0 0 0 0 0 0 0 0 0 0 0 0 1.8862 0.7347 -0.3791 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5771 0.2370 -0.9595 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9888 -2.0128 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3892 0.7617 -0.2172 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2061 -1.3812 -0.7762 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1591 -0.1533 -0.1021 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7413 1.1742 -0.1972 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2173 -1.1824 -0.1009 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3819 1.4725 -0.2908 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5521 0.4416 -0.2889 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1421 -0.8840 -0.1944 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7239 2.2992 -0.2023 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3272 -0.0073 1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5036 2.1125 0.1981 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 -2.3893 -0.5653 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5104 -2.2255 -0.0275 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0412 2.5021 -0.3646 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8434 -1.7100 -0.1974 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2003 3.2587 -0.3055 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3985 2.2569 -1.0596 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2708 2.3787 0.7352 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4609 1.0699 1.6695 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2841 -0.4791 1.8788 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5776 -0.3354 2.3617 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4066 2.5379 -0.2468 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5865 2.1678 1.2861 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6384 2.6878 -0.1404 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2856 -2.9697 -1.4852 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8553 -3.0556 0.2375 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1459 -1.9424 -0.3153 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 16 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 4 13 1 0 0 0 0 7 17 1 0 0 0 0 8 18 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 11 14 2 0 0 0 0 11 19 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 14 21 1 0 0 0 0 15 22 1 0 0 0 0 15 23 1 0 0 0 0 15 24 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

dimethoxy-(3-methyl-4-methylsulfonylphenoxy)-sulfanylidene-λ5-phosphane

4.2 InChI

InChI=1S/C10H15O5PS2/c1-8-7-9(15-16(17,13-2)14-3)5-6-10(8)18(4,11)12/h5-7H,1-4H3

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)