CAS No.: 1478-61-1 — Bisphenol AF (4,4′-(六氟异亚丙基)二酚)

1. Primary Information

English name:	Bisphenol AF
CAS No.:	1478-61-1
Molecular formula:	C₁₅H₁₀F₆O₂
Molecular weight:	336.23 g/mol
SMILES:	C1=CC(=CC=C1C(C2=CC=C(C=C2)O)(C(F)(F)F)C(F)(F)F)O
Structural class:
Other identifiers:	2,2-bis(4-hydroxyphenyl)hexafluoropropane 2,2-Bis(4-hydroxyphenyl)perfluoropropane 4,4'-(hexafluoroisopropylidene)diphenol 4,4'-hexafluorisopropylidene diphenol bisphenol AF

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	1g	GC≥98%	160	2-8℃	in stock	-
Kehua Intelligence	5g	98%	19	2-8℃	in stock	-
Kehua Intelligence	25g	98%	35	2-8℃	in stock	-
Kehua Intelligence	100g	98%	105	2-8℃	in stock	-
Kehua Intelligence	500g	98%	480	2-8℃	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 33 34 0 0 0 0 0 0 0999 V2000 -0.1760 -0.9614 2.3981 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.3229 -2.3486 1.1694 F 0 0 0 0 0 0 0 0 0 0 0 0 0.8325 -2.5731 1.3499 F 0 0 0 0 0 0 0 0 0 0 0 0 1.1183 -2.4843 -1.1649 F 0 0 0 0 0 0 0 0 0 0 0 0 0.1372 -0.9918 -2.4054 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.0466 -2.4697 -1.3268 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7506 2.3752 -0.0622 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6224 2.5120 0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0183 -0.6962 -0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2691 0.1155 -0.0174 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 0.1978 0.0158 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1627 -1.6587 1.2381 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0391 -1.6664 -1.2383 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5118 1.0020 -1.0667 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 1.0451 1.0639 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1964 -0.0115 1.0167 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1389 0.0514 -1.0192 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 1.7611 -1.0819 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5725 1.8380 1.0789 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3665 0.7476 1.0015 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2863 0.8444 -1.0043 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6093 1.6339 -0.0478 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5031 1.7377 0.0448 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7996 1.1413 -1.8745 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7009 1.1610 1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0639 -0.6821 1.8571 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0287 -0.6021 -1.8706 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8570 2.4520 -1.9023 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7326 2.5372 1.8952 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0857 0.6448 1.8097 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0024 0.7606 -1.8176 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7543 2.9326 -0.8593 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1535 2.3125 -0.7311 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 2 12 1 0 0 0 0 3 12 1 0 0 0 0 4 13 1 0 0 0 0 5 13 1 0 0 0 0 6 13 1 0 0 0 0 7 22 1 0 0 0 0 7 32 1 0 0 0 0 8 23 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 10 14 2 0 0 0 0 10 16 1 0 0 0 0 11 15 2 0 0 0 0 11 17 1 0 0 0 0 14 18 1 0 0 0 0 14 24 1 0 0 0 0 15 19 1 0 0 0 0 15 25 1 0 0 0 0 16 20 2 0 0 0 0 16 26 1 0 0 0 0 17 21 2 0 0 0 0 17 27 1 0 0 0 0 18 22 2 0 0 0 0 18 28 1 0 0 0 0 19 23 2 0 0 0 0 19 29 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 21 23 1 0 0 0 0 21 31 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

4-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxyphenyl)propan-2-yl]phenol

4.2 InChI

InChI=1S/C15H10F6O2/c16-14(17,18)13(15(19,20)21,9-1-5-11(22)6-2-9)10-3-7-12(23)8-4-10/h1-8,22-23H

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)