5,5'-(1-Methylethylidene)bis[1,1'-(bisphenyl)-2-ol]

Product Information

Molecular Formula:
C27H24O2
Molecular Weight:
380.48
Description
5,5'-(1-Methylethylidene)bis[1,1'-(bisphenyl)-2-ol] is a biomedicine used in the drug development of hormone-dependent cancers such as breast and prostate cancer. This compound exerts its therapeutic effects by modulating hormonal signaling pathways involved in tumorigenesis.
Synonyms
5,5'-ISOPROPYLIDENEBIS(2-HYDROXYBIPHENYL); 5,5''-(1-METHYLETHYLIDENE)BIS[1,1'-(BIPHENYL)-2-OL]; 4,4'-ISOPROPYLIDENEBIS(2-PHENYLPHENOL); 2,2-BIS(2-HYDROXY-5-BIPHENYL)PROPANE; 2,2-BIS(2-HYDROXY-5-BIPHENYLYL)PROPANE; Bisphenol 0PPA
IUPAC Name
4-[2-(4-hydroxy-3-phenylphenyl)propan-2-yl]-2-phenylphenol
Canonical SMILES
CC(C)(C1=CC(=C(C=C1)O)C2=CC=CC=C2)C3=CC(=C(C=C3)O)C4=CC=CC=C4
InChI
InChI=1S/C27H24O2/c1-27(2,21-13-15-25(28)23(17-21)19-9-5-3-6-10-19)22-14-16-26(29)24(18-22)20-11-7-4-8-12-20/h3-18,28-29H,1-2H3
InChI Key
BKTRENAPTCBBFA-UHFFFAOYSA-N
Boiling Point
567.411ºC at 760 mmHg
Melting Point
98-99ºC
Purity
>98.0%(LC)
Density
1.152
Appearance
White to Almost white powder to crystal

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
7.3
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
4
Exact Mass
380.177630004 g/mol
Monoisotopic Mass
380.177630004 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
29
Formal Charge
0
Complexity
459
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

Patents

Publication Number Title Priority Date
CN-113333026-A Solid acid catalyst for synthesizing bis-OPP-A and preparation method and application thereof 2021-06-08
CN-112279751-A Method for synthesizing bisphenol compound by using solid acid as catalyst 2020-10-29
CN-114163802-A Cured body 2020-09-11
CN-114173469-A Method for manufacturing light reflection substrate 2020-09-11
JP-2021001343-A Polyester resin composition 2020-09-04
JP-2022042826-A Resin composition, molded product, and manufacturing method of molded product 2020-09-03
JP-2022041689-A Thermoplastic resin, dihydroxy compound 2020-09-01
WO-2022038893-A1 Curable resin, curable resin composition, and cured product 2020-08-19
WO-2022038883-A1 Polycarbonate-polysiloxane resin 2020-08-18
JP-2022021796-A Manufacturing method and manufacturing equipment for adhesive sheet pieces, and manufacturing method for printed wiring boards 2020-07-22
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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