3-(4-Chlorophenyl)-1,2,5-oxadiazole - CAS 10349-08-3
Catalog: |
BB001151 |
Product Name: |
3-(4-Chlorophenyl)-1,2,5-oxadiazole |
CAS: |
10349-08-3 |
Synonyms: |
3-(4-chlorophenyl)-1,2,5-oxadiazole; 3-(4-chlorophenyl)-1,2,5-oxadiazole |
IUPAC Name: | 3-(4-chlorophenyl)-1,2,5-oxadiazole |
Description: | 3-(4-Chlorophenyl)-1,2,5-oxadiazole (CAS# 10349-08-3 ) is a useful research chemical. |
Molecular Weight: | 180.59 |
Molecular Formula: | C8H5ClN2O |
Canonical SMILES: | C1=CC(=CC=C1C2=NON=C2)Cl |
InChI: | InChI=1S/C8H5ClN2O/c9-7-3-1-6(2-4-7)8-5-10-12-11-8/h1-5H |
InChI Key: | PFQKBMUSFZCBOO-UHFFFAOYSA-N |
Boiling Point: | 140 ℃ (10 mmHg) |
LogP: | 2.39000 |
Publication Number | Title | Priority Date |
EP-1613610-A1 | Benzo 1,2,5 oxadiazoles and benzo 1,2,5 thiadiazoles useful as histopathological staining agents, imaging agents and biomarkers | 20030404 |
EP-1613610-B1 | Benzo 1,2,5 oxadiazoles and benzo 1,2,5 thiadiazoles useful as histopathological staining agents, imaging agents and biomarkers | 20030404 |
US-2006093551-A1 | Benzo[1,2,5]oxadiazoles and benzol[1,2,5]thiadiazoles useful as histopathological staining agents, imaging agents and biomarkers | 20030404 |
US-7632851-B2 | Benzo[1,2,5]oxadiazoles and benzol[1,2,5]thiadiazoles useful as histopathological staining agents, imaging agents and biomarkers | 20030404 |
WO-2004087684-A1 | Benzo[1,2,5]oxadiazoles and benzo [1,2,5]thiadiazoles useful as histopathological staining agents, imaging agents and biomarkers | 20030404 |
Complexity: | 148 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 180.0090405 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 180.0090405 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 38.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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