7-(Aminomethyl)benzoxazole Hydrochloride - CAS 2006276-90-8
Catalog: |
BB015493 |
Product Name: |
7-(Aminomethyl)benzoxazole Hydrochloride |
CAS: |
2006276-90-8 |
Synonyms: |
1,3-benzoxazol-7-ylmethanamine;hydrochloride; 1,3-benzoxazol-7-ylmethanamine;hydrochloride |
IUPAC Name: | 1,3-benzoxazol-7-ylmethanamine;hydrochloride |
Description: | 7-(Aminomethyl)benzoxazole Hydrochloride (CAS# 2006276-90-8) is a useful research chemical. |
Molecular Weight: | 184.62 |
Molecular Formula: | C8H9ClN2O |
Canonical SMILES: | C1=CC(=C2C(=C1)N=CO2)CN.Cl |
InChI: | InChI=1S/C8H8N2O.ClH/c9-4-6-2-1-3-7-8(6)11-5-10-7;/h1-3,5H,4,9H2;1H |
InChI Key: | KMLREPALNRLYAT-UHFFFAOYSA-N |
LogP: | 2.78880 |
Publication Number | Title | Priority Date |
WO-2020264405-A1 | Rho kinase inhibitors and compositions and methods of use thereof | 20190628 |
Complexity: | 140 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 184.0403406 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 184.0403406 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 52 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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