2-Methylbenzoxazole-6-boronic Acid - CAS 866332-15-2
Catalog: |
BB038013 |
Product Name: |
2-Methylbenzoxazole-6-boronic Acid |
CAS: |
866332-15-2 |
Synonyms: |
(2-methyl-1,3-benzoxazol-6-yl)boronic acid; (2-methyl-1,3-benzoxazol-6-yl)boronic acid |
IUPAC Name: | (2-methyl-1,3-benzoxazol-6-yl)boronic acid |
Description: | 2-Methylbenzoxazole-6-boronic Acid (CAS# 866332-15-2) is a useful research chemical. |
Molecular Weight: | 176.97 |
Molecular Formula: | C8H8NO3B |
Canonical SMILES: | B(C1=CC2=C(C=C1)N=C(O2)C)(O)O |
InChI: | InChI=1S/C8H8BNO3/c1-5-10-7-3-2-6(9(11)12)4-8(7)13-5/h2-4,11-12H,1H3 |
InChI Key: | MFPJERIVTFQLEG-UHFFFAOYSA-N |
LogP: | -0.18400 |
Publication Number | Title | Priority Date |
AU-2017296289-A1 | 2,5-disubstituted 3-methyl pyrazines and 2,5,6-trisubstituted 3-methyl pyrazines as allosteric SHP2 inhibitors | 20160712 |
CA-3030167-A1 | 2,5-disubstituted 3-methyl pyrazines and 2,5,6-trisubstituted 3-methyl pyrazines as allosteric shp2 inhibitors | 20160712 |
EP-3484856-A1 | 2,5-disubstituted 3-methyl pyrazines and 2,5,6-trisubstituted 3-methyl pyrazines as allosteric shp2 inhibitors | 20160712 |
TW-201808931-A | 2,5-disubstituted 3-methylpyrazine and 2,5,6-trisubstituted 3-methylpyrazine as ectopic SHP2 inhibitors | 20160712 |
US-10590090-B2 | 2,5-disubstituted 3-methyl pyrazines and 2,5,6-trisubstituted 3-methyl pyrazines as allosteric SHP2 inhibitors | 20160712 |
Complexity: | 190 |
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: | 1 |
Topological Polar Surface Area: | 66.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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