2,2-Bis(3-amino-4-hydroxyphenyl)hexafluoropropane

Product Information

Molecular Formula:
C15H12F6N2O2
Molecular Weight:
366.26
Description
2,2-Bis(3-amino-4-hydroxyphenyl)hexafluoropropane (CAS# 83558-87-6) is used in method for preparing continuous transparent polyimide film used in display.
Synonyms
2-amino-4-[2-(3-amino-4-hydroxyphenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenol
IUPAC Name
2-amino-4-[2-(3-amino-4-hydroxyphenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]phenol
Canonical SMILES
C1=CC(=C(C=C1C(C2=CC(=C(C=C2)O)N)(C(F)(F)F)C(F)(F)F)N)O
InChI
InChI=1S/C15H12F6N2O2/c16-14(17,18)13(15(19,20)21,7-1-3-11(24)9(22)5-7)8-2-4-12(25)10(23)6-8/h1-6,24-25H,22-23H2
InChI Key
MSTZGVRUOMBULC-UHFFFAOYSA-N
Boiling Point
411.3±45.0 °C (Predicted)
Melting Point
245-248 °C (lit.)
Purity
> 98.0 % (T)
Density
1.545 g/cm3
Appearance
White to almost white powder to crystal
LogP
4.83530

Safety Information

Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
H413:
May cause long-lasting harmful effects to aquatic life.
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning

Computed Properties

XLogP3
3.8
Hydrogen Bond Donor Count
4
Hydrogen Bond Acceptor Count
10
Rotatable Bond Count
2
Exact Mass
366.08029660 g/mol
Monoisotopic Mass
366.08029660 g/mol
Topological Polar Surface Area
92.5Ų
Heavy Atom Count
25
Formal Charge
0
Complexity
428
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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