2-Amino-5,7-dichlorobenzoxazole - CAS 98555-67-0
Catalog: |
BB042189 |
Product Name: |
2-Amino-5,7-dichlorobenzoxazole |
CAS: |
98555-67-0 |
Synonyms: |
5,7-dichloro-1,3-benzoxazol-2-amine; 5,7-dichloro-1,3-benzoxazol-2-amine |
IUPAC Name: | 5,7-dichloro-1,3-benzoxazol-2-amine |
Description: | 2-Amino-5,7-dichlorobenzoxazole (CAS# 98555-67-0) is a useful research chemical. |
Molecular Weight: | 203.03 |
Molecular Formula: | C7H4Cl2N2O |
Canonical SMILES: | C1=C(C=C2C(=C1Cl)OC(=N2)N)Cl |
InChI: | InChI=1S/C7H4Cl2N2O/c8-3-1-4(9)6-5(2-3)11-7(10)12-6/h1-2H,(H2,10,11) |
InChI Key: | NHDNAMKNESMSDH-UHFFFAOYSA-N |
LogP: | 3.29800 |
Publication Number | Title | Priority Date |
WO-2021115380-A1 | Compound having neuroprotective effect, preparation method therefor and use thereof | 20191210 |
EP-3725788-A1 | Novel heteroaryl-substituted aminoalkyl azole compounds as pesticides | 20190415 |
Complexity: | 181 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 201.9700681 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 201.9700681 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 52 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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