2,2-Bis(4-aminophenyl)hexafluoropropane

Inquiry

Molecular Formula:

C15H12F6N2

Molecular Weight:

334.26

CAS Number:

1095-78-9

Catalog Number:

1095-78-9

Product Information

Molecular Formula:

C15H12F6N2

Molecular Weight:

334.26

Description

2,2-Bis(4-aminophenyl)hexafluoropropane is a unique bifunctional reagent predominantly used in biomedical research for the development of high-performance polymers. Its fluorinated nature contributes to drug-resistance studies, specifically for cancer treatments.

Synonyms

BIS-A-AF; 2,2-BIS(4-AMINOPHENYL)HEXAFLUOROPROPANE; 6F-DIAMINE; 4,4'-(HEXAFLUOROISOPROPYLIDENE)DIANILINE; 4,4'-[2,2,2-trifluoro-1-(trifluoromethyl)ethylidene]bis-benzenamin; 2,2-Bis(4-aminophenyl)hexafluoropropane 98%; 2,2-Bis(4-aminophenyl)hexafluoropropane98%

IUPAC Name

4-[2-(4-aminophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]aniline

Canonical SMILES

C1=CC(=CC=C1C(C2=CC=C(C=C2)N)(C(F)(F)F)C(F)(F)F)N

InChI

InChI=1S/C15H12F6N2/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/h1-8H,22-23H2

InChI Key

BEKFRNOZJSYWKZ-UHFFFAOYSA-N

Boiling Point

436.5ºC at 760 mmHg

Melting Point

195-198ºC(lit.)

Purity

95%

Density

1.489 g/cm3

Appearance

white crystalline powder

Safety Information

Hazards

H315:
Causes skin irritation.
H319:
Causes serious eye irritation.

Precautionary Statement

P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].

Computed Properties

XLogP3

4.5

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

334.09046736 g/mol

Monoisotopic Mass

334.09046736 g/mol

Topological Polar Surface Area

52Å²

Heavy Atom Count

Formal Charge

Complexity

352

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
JP-2022043096-A	Resin composition, method for manufacturing cured relief pattern, and semiconductor device	2021-12-01
CN-113968987-A	Polyimide-based high-temperature-resistant electromagnetic shielding film and preparation method thereof	2021-11-30
CN-113969058-A	Antistatic polyimide film and preparation method thereof	2021-11-30
CN-114000219-A	Water-repellent and oil-repellent meta-aramid fiber and preparation method thereof	2021-10-29
CN-113652214-A	Supercritical carbon dioxide channeling sealing agent and preparation technology and application thereof	2021-10-19
CN-113652214-B	Supercritical carbon dioxide channeling sealing agent and preparation method and application thereof	2021-10-19
CN-113736084-A	Transparent polyamide-imide resin and preparation method and application thereof	2021-09-03
CN-114015044-A	Colorless transparent polyimide resin film and preparation method thereof	2021-08-30
CN-113637449-A	High-frequency adhesive and protective film prepared from same and used for high-frequency copper-clad plate	2021-08-25
CN-113620814-A	Green preparation method of 2, 2-bis (4-aminophenyl) hexafluoropropane	2021-08-10

Literatures

PMID	Publication Date	Title	Journal
21201418	2008-01-09	N,N'-{[Bis(trifluoro-meth-yl)methyl-ene]di-p-phenyl-ene}diphthalimide	Acta crystallographica. Section E, Structure reports online

The molarity calculator equation

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