1,4-Benzenedimethanol, a1,a1,a4,a4-tetramethyl-
Product Information
Molecular Formula
C12H18 O2
Molecular Weight
194.2701
Description
1,4-Benzenedimethanol, α1,α1,α4,α4-tetramethyl-, colloquially Dianol, embodies utilization in biomedical zones as an inhibitor of reactive oxygen species (ROS). It has been shown to have a strong ability to inhibit oxidative stress, which has led to its use in the study of cancer and neurodegenerative abnormalities.
Synonyms
A,A'-DIHYDROXY-1,4-DIISOPROPYLBENZENE; A,A,A',A'-TETRAMETHYL-1,4-BENZENEDIMETHANOL; A,A,A',A'-TETRAMETHYL-P-XYLENE-A,A'-DIOL; ALPHA,ALPHA,ALPHA',ALPHA'-TETRAMETHYL-1,4-BENZENEDIMETHANOL; ALPHA,ALPHA'-DIHYDROXY-P-DIISOPROPYLBENZENE; ALPHA,ALPHA'-DIHYDROXY-1,4-
IUPAC Name
2-[4-(2-hydroxypropan-2-yl)phenyl]propan-2-ol
SMILES
CC(C)(C1=CC=C(C=C1)C(C)(C)O)O
InChI
InChI=1S/C12H18O2/c1-11(2,13)9-5-7-10(8-6-9)12(3,4)14/h5-8,13-14H,1-4H3
InChI Key
LEARFTRDZQQTDN-UHFFFAOYSA-N
Boiling Point
167-168 °C/12 mmHg (lit.)
Melting Point
144-146 °C (lit.)
Flash Point
Not applicable
Purity
0.97
Density
1.051g/cm3
Safety Information
Hazards
H315 - H319 - H335
Precautionary Statement
P302 + P352 - P305 + P351 + P338
Computed Properties
XLogP3
1.3
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
2
Exact Mass
194.130679813 g/mol
Monoisotopic Mass
194.130679813 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
167
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-113999151-A | Condensation reaction method for synthesizing meta-position and para-position 2- (tert-butyl peroxyisopropyl) benzene | 2021-12-01 |
| EP-3950736-A1 | Process for preparing high-reactivity isobutene homo- or copolymers | 2020-08-05 |
| WO-2022028951-A1 | Process for preparing high-reactivity isobutene homo- or copolymers | 2020-08-05 |
| WO-2021251052-A1 | Curable resin, curable resin composition, and cured product | 2020-06-09 |
| TW-202138409-A | Curable resin, curable resin composition, and cured product | 2020-04-06 |
| JP-2021161173-A | Olefin compounds, curable resin compositions and cured products thereof | 2020-03-31 |
| KR-20210119622-A | Composition for removing particulate matter comprising extracts of sargassum thunbergii or a fraction thereof | 2020-03-24 |
| JP-2021143333-A | Olefin resin, curable resin composition and cured product thereof | 2020-03-12 |
| WO-2021100658-A1 | Compound, mixture, curable resin composition and cured product thereof, and compound production method | 2019-11-19 |
| JP-6951829-B1 | Compounds, mixtures, curable resin compositions and cured products thereof, and methods for producing compounds. | 2019-11-19 |
