2,2-Oxybisphenol
Product Information
Molecular Formula
C12H10O3
Molecular Weight
202.21
Description
2,2-Oxybisphenol is an organic compound with anti-inflammatory and antioxidant properties. It is widely used in the study of cardiovascular abnormalities and neurodegenerative diseases.
Synonyms
Bis(2-hydroxyphenyl) Ether||||2-Hydroxyphenyl Ether||||2,2'-Oxybisphenol||||2,2'-Oxydiphenol
IUPAC Name
2-(2-hydroxyphenoxy)phenol
SMILES
C1=CC=C(C(=C1)O)OC2=CC=CC=C2O
InChI
InChI=1S/C12H10O3/c13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)14/h1-8,13-14H
InChI Key
VXHYVVAUHMGCEX-UHFFFAOYSA-N
Melting Point
123 °C
Purity
>98.0%(GC)
Appearance
White to Almost white powder to crystal
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
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].
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
2.7
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
2
Exact Mass
202.062994177 g/mol
Monoisotopic Mass
202.062994177 g/mol
Topological Polar Surface Area
49.7Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
175
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 |
|---|---|---|
| WO-2022054897-A1 | Curing agent composition for epoxy resins, epoxy resin composition, and coating material | 2020-09-14 |
| WO-2022043424-A1 | Hydrolysis-resistant polycarbonate composition | 2020-08-31 |
| WO-2022034898-A1 | Thermoplastic resin composition for optical material, molded article, compounding agent, method for producing thermoplastic resin composition, and method for improving transmissivity | 2020-08-13 |
| WO-2022029260-A1 | Thermoplastic mixtures | 2020-08-07 |
| CN-112010787-A | Agricultural preparation dispersant, preparation method and application thereof | 2020-07-29 |
| JP-2022021149-A | A composition, a synthetic resin composition containing the composition, and a molded product thereof. | 2020-07-21 |
| WO-2022014338-A1 | Stabilizer composition, vinyl chloride resin composition containing same, and molded body of same | 2020-07-17 |
| JP-2022014019-A | Polycarbonate resin composition | 2020-07-06 |
| JP-2022013866-A | Temperature control indicator and how to use it | 2020-06-30 |
| EP-3933059-A1 | Process for the preparation of a polycarbonate | 2020-06-29 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 16539372 | 2006-03-23 | Enantiomer discrimination illustrated by the high resolution crystal structures of type 4 phosphodiesterase | Journal of medicinal chemistry |
| 15491144 | 2004-10-26 | Role of inhibitor aliphatic chain in the thermodynamics of inhibitor binding to Escherichia coli enoyl-ACP reductase and the Phe203Leu mutant: a proposed mechanism for drug resistance | Biochemistry |
| 14736233 | 2004-01-29 | Inhibition of the bacterial enoyl reductase FabI by triclosan: a structure-reactivity analysis of FabI inhibition by triclosan analogues | Journal of medicinal chemistry |
| 3821 | 1975-09-01 | [Automatic method for determination of serum antistreptolysin] | Quaderni Sclavo di diagnostica clinica e di laboratorio |
