CAS Number145-39-1
Synonyms5-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; 2-tert-Butyl-1,3-dinitro-4,5,6-trimethylbenzene; Tibetene musk; 1-t-butyl-3,4,5-trimethyl-2,6-dinitrobenzene; musk tibeten
Molecular FormulaC13H18N2O4
Molecular Weight266.299
Density1.2±0.1 g/cm3
Boiling Point391.0±42.0 °C at 760 mmHg
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 145-39-1 |
| Catalog No. | 2A-2176819 |
| Chinese Name | 1-叔丁基-3,4,5-三甲基-2,6-二硝基-苯 |
| 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; 2-tert-Butyl-1,3-dinitro-4,5,6-trimethylbenzene; Tibetene musk; 1-t-butyl-3,4,5-trimethyl-2,6-dinitrobenzene; musk tibeten |
| Molecular Formula | C13H18N2O4 |
| Molecular Weight | 266.299 |
| Density | 1.2±0.1 g/cm3 |
| Boiling Point | 391.0±42.0 °C at 760 mmHg |
| Storage Condition | room temperature |
| Application | Musk tibetene (Musk tibetine) is a nitromusk compound with anticancer activity. Musk tibetine showed no genotoxicity in micronucleus assays on human lymphocytes and human liver cancer cell lines. |
| HTC | 2904209090 |
| MDL Number | MFCD00024266 |
| SMILES | Cc1c(C)c([N+](=O)[O-])c(C(C)(C)C)c([N+](=O)[O-])c1C |
| InChI | InChI=1S/C13H18N2O4/c1-7-8(2)11(14(16)17)10(13(4,5)6)12(9(7)3)15(18)19/h1-6H3 |
| InChI Key | MINYPECWDZURGR-UHFFFAOYSA-N |
| MSDS | msds/177354_1_145_39_1.pdf |
| Use of | 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]. Properties Name 1-tert-butyl-3,4,5-trimethyl-2,6-dinitrobenzene Synonym More Synonyms Musk tibetene Biological Activity 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 >> Cancer Signaling 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 Molecular Formula C13H18N2O4 Exact Mass 266.126648 PSA 91.64000 Index of Refraction 1.544 InChIKey MINYPECWDZURGR-UHFFFAOYSA-N Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : CHEMICAL NAME : Benzene, 1-(1,1-dimethylethyl)-2,6-dinitro-3,4,5-trimethyl- CAS REGISTRY NUMBER : BEILSTEIN REFERENCE NO. : LAST UPDATED : DATA ITEMS CITED : MOLECULAR FORMULA : C13-H18-N2-O4 MOLECULAR WEIGHT : WISWESSER LINE NOTATION : HEALTH HAZARD DATA ACUTE 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 : SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 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 : 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 HS Code 2904209090 Synthetic Route Total: 1 Page 1-tert-butyl-3,... CAS#:98-23-7 Musk tibetene CAS#:145-39-1 Literature: Gigante, Barbara; Prazeres, Angela O.; Marcelo-Curto, Maria J.; Cornelis, Andre; Laszlo, Pierre Journal of Organic Chemistry, 1995 , vol. 60, # 11 p. 3445 - 3447 |
| Tax Rebate | 9.0% |
| Supervision | none |
| Transport Info | Product name: 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% |
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