4-Cyano-2-methoxyphenylboronic Acid - CAS 1256345-67-1
Catalog: |
BB006151 |
Product Name: |
4-Cyano-2-methoxyphenylboronic Acid |
CAS: |
1256345-67-1 |
Synonyms: |
(4-cyano-2-methoxyphenyl)boronic acid; (4-cyano-2-methoxyphenyl)boronic acid |
IUPAC Name: | (4-cyano-2-methoxyphenyl)boronic acid |
Description: | 4-Cyano-2-methoxyphenylboronic Acid (CAS# 1256345-67-1) is a useful research chemical. |
Molecular Weight: | 176.97 |
Molecular Formula: | C8H8NO3B |
Canonical SMILES: | B(C1=C(C=C(C=C1)C#N)OC)(O)O |
InChI: | InChI=1S/C8H8BNO3/c1-13-8-4-6(5-10)2-3-7(8)9(11)12/h2-4,11-12H,1H3 |
InChI Key: | CCUBWDNQHCIXNF-UHFFFAOYSA-N |
Appearance: | Solid |
LogP: | -0.75332 |
Publication Number | Title | Priority Date |
EP-3878891-A1 | Dynamic covalent hydrogels, precursors thereof and uses thereof | 20200310 |
WO-2021180795-A1 | Dynamic covalent hydrogels, precursors thereof and uses thereof | 20200310 |
CA-3070013-A1 | Substituted pyrrolopyridine-derivatives | 20170718 |
EP-3655406-A1 | Substituted pyrrolopyridine-derivatives | 20170718 |
WO-2019016071-A1 | SUBSTITUTED PYRROLOPYRIDINE DERIVATIVES | 20170718 |
Complexity: | 213 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 177.0597233 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 177.0597233 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 73.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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