Introduction:Basic information about CAS 41933-33-9|2-Benzyl-4,5-dichloropyridazine-3(2H)-one, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-Benzyl-4,5-dichloropyridazine-3(2H)-one |
|---|
| CAS Number | 41933-33-9 | Molecular Weight | 255.10000 |
|---|
| Density | 1.38g/cm3 | Boiling Point | 338ºC at 760 mmHg |
|---|
| Molecular Formula | C11H8Cl2N2O | Melting Point | 87ºC |
|---|
| MSDS | / | Flash Point | 158.2ºC |
|---|
Names
| Name | 2-Benzyl-4,5-dichloropyridazin-3(2H)-one |
|---|
| Synonym | More Synonyms |
|---|
BiologicalActivity
| Description | EcDsbB-IN-9 (Compound 9) is a potent E. coli DsbB (EcDsbB) inhibitor with an IC50 of 1.7 μM and a Ki of 46 nM[1]. |
|---|
| Related Catalog | Research Areas >>InfectionSignaling Pathways >>Others >>Others |
|---|
| Target | IC50: 1.7 μM (EcDsbB)[1] Ki: 46 nM (EcDsbB)[1] |
|---|
| In Vitro | EcDsbB-IN-9 (Compound 9) (0-100 μM) causes accumulation of reduced DsbA (EcDsbB substrate) and inhibits oxidation of DsbA with an IC50 of 8.5 ± 0.6 μM[1]. |
|---|
Chemical & Physical Properties
| Density | 1.38g/cm3 |
|---|
| Boiling Point | 338ºC at 760 mmHg |
|---|
| Melting Point | 87ºC |
|---|
| Molecular Formula | C11H8Cl2N2O |
|---|
| Molecular Weight | 255.10000 |
|---|
| Flash Point | 158.2ºC |
|---|
| Exact Mass | 254.00100 |
|---|
| PSA | 34.89000 |
|---|
| LogP | 2.59840 |
|---|
| Index of Refraction | 1.626 |
|---|
| InChIKey | AJHBQZQCDCTOFD-UHFFFAOYSA-N |
|---|
| SMILES | O=c1c(Cl)c(Cl)cnn1Cc1ccccc1 |
|---|
Safety Information
| Hazard Codes | Xi:Irritant; |
|---|
| Risk Phrases | R36/37/38 |
|---|
| Safety Phrases | S26-S37/39 |
|---|
| HS Code | 2933990090 |
|---|
Customs
| HS Code | 2933990090 |
|---|
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
|---|
Synonyms
| 2-benzyl-4,5-dichloropyridazin-3-one |