Introduction:Basic information about CAS 145-39-1|Musk tibetene, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Musk tibetene |
|---|
| CAS Number | 145-39-1 | Molecular Weight | 266.293 |
|---|
| Density | 1.2±0.1 g/cm3 | Boiling Point | 391.0±42.0 °C at 760 mmHg |
|---|
| Molecular Formula | C13H18N2O4 | Melting Point | / |
|---|
| MSDS | / | Flash Point | 174.6±20.7 °C |
|---|
Names
| Name | 1-tert-butyl-3,4,5-trimethyl-2,6-dinitrobenzene |
|---|
| Synonym | More Synonyms |
|---|
Musk tibetene BiologicalActivity
| Description | Musk tibetene (Musk tibetine) is a nitro musk compound with carcinogenic activity. Musk tibetine reveals no genotoxicity in the micronucleus test with human lymphocytes and human hepatoma cell line[1][2]. |
|---|
| Related Catalog | Research Areas >>CancerSignaling Pathways >>Others >>Others |
|---|
| In Vitro | Musk tibetene reveals no genotoxicity in the micronucleus test with human lymphocytes and with the human hepatoma cell line Hep G2[1]. Musk tibetene reveals a cell-transforming potential that showed a dose-dependent response in our host-mediated assay system[2]. |
|---|
| References | [1]. Kevekordes S, et al. Genotoxicity of nitro musks in the micronucleus test with human lymphocytes in vitro and the human hepatoma cell line Hep G2. Toxicol Lett. 1997 Mar 14;91(1):13-7. [2]. Apostolidis S, et al. Evaluation of carcinogenic potential of two nitro-musk derivatives, musk xylene and musk tibetene in a host-mediated in vivo/in vitro assay system. Anticancer Res. 2002 Sep-Oct;22(5):2657-62. |
|---|
Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
|---|
| Boiling Point | 391.0±42.0 °C at 760 mmHg |
|---|
| Molecular Formula | C13H18N2O4 |
|---|
| Molecular Weight | 266.293 |
|---|
| Flash Point | 174.6±20.7 °C |
|---|
| Exact Mass | 266.126648 |
|---|
| PSA | 91.64000 |
|---|
| LogP | 4.68 |
|---|
| Vapour Pressure | 0.0±0.9 mmHg at 25°C |
|---|
| Index of Refraction | 1.544 |
|---|
| InChIKey | MINYPECWDZURGR-UHFFFAOYSA-N |
|---|
| SMILES | Cc1c(C)c([N+](=O)[O-])c(C(C)(C)C)c([N+](=O)[O-])c1C |
|---|
Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- CZ7220000
- CHEMICAL NAME :
- Benzene, 1-(1,1-dimethylethyl)-2,6-dinitro-3,4,5-trimethyl-
- CAS REGISTRY NUMBER :
- 145-39-1
- BEILSTEIN REFERENCE NO. :
- 2000732
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 5
- MOLECULAR FORMULA :
- C13-H18-N2-O4
- MOLECULAR WEIGHT :
- 266.33
- WISWESSER LINE NOTATION :
- WNR B1 C1 D1 ENW FX1&1&1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration into the eye
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 13,879,1975 ** ACUTE TOXICITY DATA **
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >6 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 13,879,1975
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- >5 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 13,879,1975 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X2783 No. of Facilities: 7 (estimated) No. of Industries: 1 No. of Occupations: 5 No. of Employees: 1557 (estimated) No. of Female Employees: 276 (estimated)
|
Safety Information
Customs
| HS Code | 2904209090 |
|---|
| Summary | 2904209090 derivatives containing only nitro or only nitroso groups。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0% |
|---|
Synonyms
| 5-tert-Butyl-4,6-dinitro-1,2,3-trimethylbenzene |
| 1-tert-butyl-4,3,5-trimethyl-2-amino-6-nitrobenzene |
| 1,2,3-Trimethyl-5-(2-methyl-2-propanyl)-4,6-dinitrobenzene |
| EINECS 205-651-6 |
| Musk tibetine |
| 1-tert-butyl-3,4,5-trimethyl-2,6-dinitro-benzene |
| Musk tibetene |
| Musk Tebetine |
| Nitromusk tibetene |
| 1-tert-Butyl-3,4,5-trimethyl-2,6-dinitrobenzene |
| Benzene, 1- (1,1-dimethylethyl)-3,4,5-trimethyl-2,6-dinitro- |
| 2-tert-Butyl-1,3-dinitro-4,5,6-trimethylbenzene |
| Benzene, 1-(1,1-dimethylethyl)-3,4,5-trimethyl-2,6-dinitro- |
| Tibetene musk |
| 1-t-butyl-3,4,5-trimethyl-2,6-dinitrobenzene |
| musk tibeten |