Benzenamine, 4,4'-[[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]bis(4,1-phenyleneoxy)]bis-

HCID 94652

Basic information

CAS
69563-88-8
Standard SMILES
Nc1ccc(Oc2ccc(C(c3ccc(Oc4ccc(N)cc4)cc3)(C(F)(F)F)C(F)(F)F)cc2)cc1
InChIKey
HHLMWQDRYZAENA-UHFFFAOYSA-N
Molecular formula
C27H20F6N2O2
Average molar mass
518.4 g/mol
Monoisotopic mass
518.1428972

Names & identifiers

Preferred name
Benzenamine, 4,4'-[[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]bis(4,1-phenyleneoxy)]bis-
IUPAC
4-[4-[2-[4-(4-aminophenoxy)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl]phenoxy]aniline
English name
2,2-Bis[4-(4-aminophenoxy)phenyl]hexafluoropropane
Molecular formula
C27H20F6N2O2
Molecular weight
518.45

Names & synonyms

2,2-Bis[4-(4-aminophenoxy)phenyl]hexafluoropropane4-BDAF2,2-Bis(4-(4-aminophenoxy)phenyl)hexafluoropropane4,4'-((2,2,2-Trifluoro-1-(trifluoromethyl)ethylidene)bis(4,1-phenyleneoxy))bisbenzenamineBenzenamine, 4,4'-((2,2,2-trifluoro-1-(trifluoromethyl)ethylidene)bis(4,1-phenyleneoxy))bis-2,2-Bis(4-[4-aminophenoxy]phenyl)hexafluoropropane4,4'-[[2,2,2-Trifluoro-1-(trifluoromethyl)ethylidene]bis(4,1-phenyleneoxy)]bis[benzenamine]Benzenamine, 4,4'-[[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]bis(4,1-phenyleneoxy)]bis-4,4'-((2,2,2-Trifluoro-1-(trifluoromethyl)ethylidene)bis(4,1-phenyleneoxy))bis(benzenamine)RefChem:561739626-703-869563-88-8
Show more names
HFBAPP6FBAPP4-(4-aminophenoxy)phenylBAPOFPBIS-AF-AGI 530159isbenzenamineleneoxy))bis-
GI-5301594,4'-(((Perfluoropropane-2,2-diyl)bis(4,1-phenylene))bis(oxy))dianilineMFCD00015723C27H20F6N2O2479545-03-44,4'-(Hexafluoroisopropylidene)bis(p-phenyleneoxy)dianiline4-(4-{2-[4-(4-aminophenoxy)phenyl]-1,1,1,3,3,3-hexafluoropropan-2-yl}phenoxy)aniline2,2-bis[4-(4-aminophenoxy)phenyl]-hexafluoropropane

Database identifiers

CAS
69563-88-8
PubChem CID
94652
DTXSID
DTXSID3071987
ChEMBL
CHEMBL4562388
EC Number
626-703-8
Nikkaji
J236.198A

Properties

Computed structural properties

XLogP
7.6
Topological polar surface area
70.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
10
Rotatable bonds
6
Heavy atoms
37

Physicochemical properties

Melting point
159 · 159-163 °C(lit.)
Boiling point
544.8 · 544.8±50.0 °C(Predicted)
Density
1.3455 · 1.3455 (estimate)
storage temp.
Keep in dark place,Inert atmosphere,Room temperature
Water Solubility
Insoluble in water
solubility
Soluble in DMSO

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

wgk
3
tsca
TSCA listed
rtecs
CY1213000
hs_code
29222990
risk_code
22-36/37/38
Signal word
Warning

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationBenzenamine, 4,4'-[[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]bis(4,1-phenyleneoxy)]bis-: ACTIVE
Applications · 3 items

Uses2,2-bis[4-(4-Aminophenoxy)phenyl]hexafluoropropane (cas# 69563-88-8) has been used in the preparation of permeable membranes for atmospheric CO2 capture and gas transport.

Description2,2-Bis[4-(4-aminophenoxy)phenyl]hexafluoropropane (4-BDAF or HFBAPP) is composed of two phenoxyanilines linked by a hexafluoroisopropane. 4-BDAF is commonly used in the synthesis of polyimides, and the semicrystalline and amorphous fluorinated polyimides developed have high transition temperatures and good The developed semi-crystalline and amorphous fluorinated polyimides have high transition temperatures and good thermal stability. Polyimides derived from 4-BDAF and trimellitic anhydride (PMDA) are semi-crystalline and have a melting point of 472°C. Addition of 6F dianhydride (2,2′-bis(3,4-dicarboxyphenyl)hexafluoropropane dianhydride, 6FDA) as a copolymer monomer to the PMDA/4-BDAF polyimides lowers the melting point to 440°C. The melting point of the polyimides is reduced to 440°C by using 1,1-bis(4-aminophenyl)-1 Polyimides based on 1,1-bis(4-aminophenyl)-1-phenyl-2,2,2-trifluoroethane (3F diamine, 3FDAM) are soluble and amorphous. The glass transition temperature of PMDA/3FDAM-based polyimides exceeds 420°C. These fluoropolyimide systems are currently being investigated as candidates for high-temperature applications[1].

Uses2,2-BIS[4-(4-AMINOPHENOXY)PHENYL]HEXAFLUOROPROPANE is used for the preparation of a polyimide material.

Upstream & downstream products

Upstream raw materials

Suppliers100 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
中节能万润股份有限公司0535-6101880 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]

Related reactions

1 records

Compound notes

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