CAS 56-49-5|3-Methylcholanthrene
| Common Name | 3-Methylcholanthrene | ||
|---|---|---|---|
| CAS Number | 56-49-5 | Molecular Weight | 268.352 |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 506.4±30.0 °C at 760 mmHg |
| Molecular Formula | C21H16 | Melting Point | 178-180ºC |
| MSDS | ChineseUSA | Flash Point | 253.2±18.7 °C |
| Symbol | GHS08 | Signal Word | Danger |
Names
| Name | 3-methylcholanthrene |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 506.4±30.0 °C at 760 mmHg |
| Melting Point | 178-180ºC |
| Molecular Formula | C21H16 |
| Molecular Weight | 268.352 |
| Flash Point | 253.2±18.7 °C |
| Exact Mass | 268.125214 |
| LogP | 7.11 |
| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
| Index of Refraction | 1.781 |
| InChIKey | PPQNQXQZIWHJRB-UHFFFAOYSA-N |
| SMILES | Cc1ccc2cc3c(ccc4ccccc43)c3c2c1CC3 |
| Storage condition | 2-8°C |
| Stability | Stable. Combustible. Incompatible with strong oxidizing agents. |
Safety Information
| Symbol | GHS08 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H350-H413 |
| Precautionary Statements | P201-P308 + P313 |
| Personal Protective Equipment | Eyeshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges |
| Hazard Codes | T,Xn,F |
| Risk Phrases | R45 |
| Safety Phrases | 53-36/37/39-45-36-26-16-36/37 |
| RIDADR | UN 2811 |
| WGK Germany | 3 |
| RTECS | FZ3675000 |
| Packaging Group | III |
| Hazard Class | 6.1(b) |
| HS Code | 2902909090 |
Customs
| HS Code | 2902909090 |
|---|---|
| Summary | 2902909090 other aromatic hydrocarbons。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:2.0%。General tariff:30.0% |
Articles52
More Articles| Translating clinical findings into knowledge in drug safety evaluation--drug induced liver injury prediction system (DILIps). J. Sci. Ind. Res. 65(10) , 808, (2006) Drug-induced liver injury (DILI) is a significant concern in drug development due to the poor concordance between preclinical and clinical findings of liver toxicity. We hypothesized that the DILI typ... | |
| Developing structure-activity relationships for the prediction of hepatotoxicity. Chem. Res. Toxicol. 23 , 1215-22, (2010) Drug-induced liver injury is a major issue of concern and has led to the withdrawal of a significant number of marketed drugs. An understanding of structure-activity relationships (SARs) of chemicals ... | |
| HepG2 cells as an in vitro model for evaluation of cytochrome P450 induction by xenobiotics. Arch. Pharm. Res. 38 , 691-704, (2015) Although various in vitro assays have been developed to evaluate the cytochrome P450 (CYP)-inducing potential of drug candidates, there is a continuing need for the development of a reliable model in ... |
Synonyms
| MFCD00003704 |
| 3-Methylcholanthrene |
| EINECS 200-276-4 |
| 3-Methyl-1,2-dihydrocyclopenta[ij]tetraphene |
| 3-methyl-1,2-dihydrobenzo[j]aceanthrylene |
| Benz[j]aceanthrylene, 1,2-dihydro-3-methyl- |
