2-Chloro-4-hydroxyphenylboronic Acid - CAS 766549-26-2
Catalog: |
BB035657 |
Product Name: |
2-Chloro-4-hydroxyphenylboronic Acid |
CAS: |
766549-26-2 |
Synonyms: |
(2-chloro-4-hydroxyphenyl)boronic acid; (2-chloro-4-hydroxyphenyl)boronic acid |
IUPAC Name: | (2-chloro-4-hydroxyphenyl)boronic acid |
Description: | 2-Chloro-4-hydroxyphenylboronic Acid (CAS# 766549-26-2) is a useful research chemical. |
Molecular Weight: | 172.37 |
Molecular Formula: | C6H6ClO3B |
Canonical SMILES: | B(C1=C(C=C(C=C1)O)Cl)(O)O |
InChI: | InChI=1S/C6H6BClO3/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3,9-11H |
InChI Key: | NRBQMBXPVAUMJY-UHFFFAOYSA-N |
Boiling Point: | 380.7 °C at 760 mmHg |
Density: | 1.49 g/cm3 |
LogP: | -0.27460 |
Publication Number | Title | Priority Date |
US-2021171529-A1 | Heterocyclic compounds as delta-5 desaturase inhibitors and methods of use | 20191125 |
WO-2021108404-A1 | Heterocyclic compounds as delta-5 desaturase inhibitors and methods of use | 20191125 |
CN-112574224-A | KRAS G12C inhibitor and application thereof | 20190930 |
WO-2021063346-A1 | Kras g12c inhibitor and application thereof | 20190930 |
WO-2019138107-A1 | Inhibitors of indoleamine 2,3-dioxygenase and/or tryptophan 2,3-dioxygenase | 20180115 |
Complexity: | 133 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.0098519 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.0098519 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 60.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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