2-Amino-6-nitrobenzoxazole - CAS 6458-17-9
Catalog: |
BB032509 |
Product Name: |
2-Amino-6-nitrobenzoxazole |
CAS: |
6458-17-9 |
Synonyms: |
6-nitro-1,3-benzoxazol-2-amine; 6-nitro-1,3-benzoxazol-2-amine |
IUPAC Name: | 6-nitro-1,3-benzoxazol-2-amine |
Description: | 2-Amino-6-nitrobenzoxazole (CAS# 6458-17-9 ) is a useful research chemical. |
Molecular Weight: | 179.13 |
Molecular Formula: | C7H5N3O3 |
Canonical SMILES: | C1=CC2=C(C=C1[N+](=O)[O-])OC(=N2)N |
InChI: | InChI=1S/C7H5N3O3/c8-7-9-5-2-1-4(10(11)12)3-6(5)13-7/h1-3H,(H2,8,9) |
InChI Key: | UHYVXILHAMUPRP-UHFFFAOYSA-N |
LogP: | 1.77150 |
Publication Number | Title | Priority Date |
TW-201005006-A | Liquid crystal alignment agent and liquid crystal display element | 20080617 |
AU-2005321517-A1 | 2, 5 and 2, 6-disubstituted benzazole analogues useful as protein kinase inhibitors | 20041227 |
AU-2005321517-B2 | 2, 5 and 2, 6-disubstituted benzazole analogues useful as protein kinase inhibitors | 20041227 |
CA-2592509-A1 | Benzazole analogues and uses thereof | 20041227 |
CA-2592509-C | Benzazole analogues and uses thereof | 20041227 |
Complexity: | 218 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 179.03309103 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 179.03309103 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 97.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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Related Functional Groups
Benzoxazole/Benzothiazole
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