CAS No.: 5074-71-5 — Bis(pentafluorophenyl)phenylphosphine (双(五氟苯基)苯膦)

1. Primary Information

English name:	Bis(pentafluorophenyl)phenylphosphine
CAS No.:	5074-71-5
Molecular formula:	C₁₈H₅F₁₀P
Molecular weight:	442.2 g/mol
SMILES:	C1=CC=C(C=C1)P(C2=C(C(=C(C(=C2F)F)F)F)F)C3=C(C(=C(C(=C3F)F)F)F)F
Structural class:
Other identifiers:	bis(pentafluorophenyl)phenylphosphine decafluorotriphenylphosphine DFTPP

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	1.2ml	1000μg/ml in dichloromethane	392	2-8℃	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 34 36 0 0 0 0 0 0 0999 V2000 -0.0086 0.3911 1.4896 P 0 0 0 0 0 0 0 0 0 0 0 0 1.7355 -1.9613 2.2697 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.7278 -1.9861 2.2494 F 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 1.2860 -1.1672 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.1467 1.2757 -1.1760 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 0.2200 -2.5162 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.2185 0.1849 -2.5456 F 0 0 0 0 0 0 0 0 0 0 0 0 3.8301 -3.0068 0.8993 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.7958 -3.0567 0.8580 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5914 -1.9253 -1.4935 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.5501 -1.9805 -1.5394 F 0 0 0 0 0 0 0 0 0 0 0 0 1.4002 -0.3183 0.5762 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4026 -0.3370 0.5599 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0206 2.1620 1.0509 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0898 -1.4129 1.0979 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0787 -1.4401 1.0754 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7889 0.2334 -0.6446 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7843 0.2136 -0.6613 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1741 2.8069 0.7405 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2241 2.8624 1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8668 -0.3095 -1.3439 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8487 -0.3422 -1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1679 -1.9557 0.3987 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1431 -1.9959 0.3655 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5563 -1.4039 -0.8221 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5280 -1.4468 -0.8577 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1653 4.1609 0.4054 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2328 4.2164 0.6928 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 4.8656 0.3814 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1451 2.3275 0.8248 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1690 2.3918 1.2875 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0974 4.6714 0.1814 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1690 4.7670 0.6798 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0442 5.9211 0.1258 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 15 1 0 0 0 0 3 16 1 0 0 0 0 4 17 1 0 0 0 0 5 18 1 0 0 0 0 6 21 1 0 0 0 0 7 22 1 0 0 0 0 8 23 1 0 0 0 0 9 24 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 12 15 2 0 0 0 0 12 17 1 0 0 0 0 13 16 2 0 0 0 0 13 18 1 0 0 0 0 14 19 2 0 0 0 0 14 20 1 0 0 0 0 15 23 1 0 0 0 0 16 24 1 0 0 0 0 17 21 2 0 0 0 0 18 22 2 0 0 0 0 19 27 1 0 0 0 0 19 30 1 0 0 0 0 20 28 2 0 0 0 0 20 31 1 0 0 0 0 21 25 1 0 0 0 0 22 26 1 0 0 0 0 23 25 2 0 0 0 0 24 26 2 0 0 0 0 27 29 2 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 29 34 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

bis(2,3,4,5,6-pentafluorophenyl)-phenylphosphane

4.2 InChI

InChI=1S/C18H5F10P/c19-7-9(21)13(25)17(14(26)10(7)22)29(6-4-2-1-3-5-6)18-15(27)11(23)8(20)12(24)16(18)28/h1-5H

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)