Benzoxazole-6-boronic Acid - CAS 1253912-47-8
Catalog: |
BB006108 |
Product Name: |
Benzoxazole-6-boronic Acid |
CAS: |
1253912-47-8 |
Synonyms: |
1,3-benzoxazol-6-ylboronic acid; 1,3-benzoxazol-6-ylboronic acid |
IUPAC Name: | 1,3-benzoxazol-6-ylboronic acid |
Description: | Benzoxazole-6-boronic Acid (CAS# 1253912-47-8 ) is a useful research chemical. |
Molecular Weight: | 162.94 |
Molecular Formula: | C7H6NO3B |
Canonical SMILES: | B(C1=CC2=C(C=C1)N=CO2)(O)O |
InChI: | InChI=1S/C7H6BNO3/c10-8(11)5-1-2-6-7(3-5)12-4-9-6/h1-4,10-11H |
InChI Key: | ZMNCHLJKWPCQFR-UHFFFAOYSA-N |
LogP: | -0.49240 |
Publication Number | Title | Priority Date |
CN-112390778-A | Heteroanthracene derivative, application thereof and organic electroluminescent device | 20201014 |
AU-2018302179-A1 | Heterocyclic compounds as adenosine antagonists | 20170718 |
EP-3654978-A1 | Heterocyclic compounds as adenosine antagonists | 20170718 |
KR-20200041315-A | Heterocyclic compounds as adenosine antagonists | 20170718 |
US-2019023666-A1 | Heterocyclic compounds as adenosine antagonists | 20170718 |
Complexity: | 167 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 163.0440732 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 163.0440732 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 66.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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