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2-METHOXY-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENOL

2-METHOXY-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENOL

Inquiry

Molecular Formula:

C13H19BO4

Molecular Weight:

250.1

CAS Number:

269410-22-2

Catalog Number:

269410-22-2

Product Information

Molecular Formula:

C13H19BO4

Molecular Weight:

250.1

Description

2-METHOXY-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENOL is a biomedical compound bestowed with profound medicinal prospects. Renowned for its extraordinary antioxidant attributes, this wonderous solution finds extensive applications in remedial measures targeted at oxidative stress-induced illnesses. Given its distinctive and intricate molecular configuration, this exquisite entity emerges as an auspicious contender for pioneering the creation of groundbreaking pharmaceuticals, effectively countering a wide array of disorders arising from oxidative impairment.

Synonyms

4-HYDROXY-3-METHOXYPHENYLBORONIC ACID, PINACOL CYCLIC ESTER; 4-HYDROXY-3-METHOXYPHENYLBORONIC ACID PINACOL ESTER; 2-METHOXY-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENOL; 2-Methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol,min.97%; 2-METH

IUPAC Name

2-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C=C2)O)OC

InChI

InChI=1S/C13H19BO4/c1-12(2)13(3,4)18-14(17-12)9-6-7-10(15)11(8-9)16-5/h6-8,15H,1-5H3

InChI Key

WFSJROCEOJANPD-UHFFFAOYSA-N

Boiling Point

367.3°C at 760mmHg

Melting Point

105-109°C(lit.)

Flash Point

Not applicable

Purity

Density

1.11g/cm3

Appearance

white to cream crystalline powder

Storage

Refrigerator (+4°C)

Safety Information

Hazards

H315 - H319 - H335

Precautionary Statement

P302 + P352 - P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

250.1376392 g/mol

Monoisotopic Mass

250.1376392 g/mol

Topological Polar Surface Area

47.9Å²

Heavy Atom Count

Formal Charge

Complexity

289

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
KR-102259694-B1	Synthesis of new compounds via oxidative dearomatization of phenols and application thereof	2019-11-11
KR-20210057258-A	Synthesis of new compounds via oxidative dearomatization of phenols and application thereof	2019-11-11
WO-2021055295-A1	Brd9 bifunctional degraders and their methods of use	2019-09-16
TW-202123942-A	Brd9 bifunctional degraders and their methods of use	2019-09-16
CN-112341434-A	PI3K/mTOR protein degradation targeting chimera compound and preparation method and medical application thereof	2019-08-08
CN-112341434-B	PI3K/mTOR protein degradation targeting chimera compound and preparation method and medical application thereof	2019-08-08
US-2020397697-A1	Formulations of tie-2 activators and methods of use thereof	2019-06-24
TW-202019946-A	Acetamide compound with induction effect of BIT protein decomposition and its use as medicine	2018-07-04
CN-110997671-A	Azaindole compounds as histone methyltransferase inhibitors	2017-06-09
TW-201920165-A	Nitrogen-based compound as a histone methyltransferase inhibitor	2017-06-09

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