CAS Number464-10-8
SynonymsBromopicrin; Methane,nitrotribromo; tribromo-nitro-methane; Nitrobromoform; 1,1,1-tribromonitromethane; Nitrotribromomethane; Bromopicrin (tribromonitromethane); Tribromo(nitro)methane; Tribrom-nitro-methan; Methane,tribromonitro
Molecular FormulaCBr3NO2
Molecular Weight297.728
Purity98.00%
Density3.1±0.1 g/cm3
Boiling Point155.9±35.0 °C at 760 mmHg
Melting Point10 °C
Appearancelight brown liquid
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 464-10-8 |
| Catalog No. | 2A-9022061 |
| Chinese Name | 三溴硝基甲烷 |
| Synonyms | Bromopicrin; Methane,nitrotribromo; tribromo-nitro-methane; Nitrobromoform; 1,1,1-tribromonitromethane; Nitrotribromomethane; Bromopicrin (tribromonitromethane); Tribromo(nitro)methane; Tribrom-nitro-methan; Methane,tribromonitro |
| Molecular Formula | CBr3NO2 |
| Molecular Weight | 297.728 |
| Purity | 98.00 |
| Density | 3.1±0.1 g/cm3 |
| Boiling Point | 155.9±35.0 °C at 760 mmHg |
| Melting Point | 10 °C |
| Appearance | light brown liquid |
| Storage Condition | 2-8 °C, inert gas |
| Application | Tribromonitromethane is a halogenated nitromethane product that is a disinfection by-product in drinking water. |
| HTC | 2904909090 |
| SMILES | O=[N+]([O-])C(Br)(Br)Br |
| InChI | InChI=1S/CBr3NO2/c2-1(3,4)5(6)7 |
| InChI Key | QQZIUHOKWDFXEY-UHFFFAOYSA-N |
| Use of | Tribromonitromethane is one of Halonitromethanes, which are a recently identified class of disinfection by-products (DBPs) in drinking water[1]. Properties Name tribromo(nitro)methane Synonym More Synonyms Tribromonitromethane Biological Activity Description Tribromonitromethane is one of Halonitromethanes, which are a recently identified class of disinfection by-products (DBPs) in drinking water[1]. Related Catalog Research Areas >> Others Signaling Pathways >> Others >> Others References [1]. Bijit Kundu, et al. Mutagenicity in Salmonella of halonitromethanes: a recently recognized class of disinfection by-products in drinking water. Mutat Res. 2004 Aug 8;562(1-2):39-65. Chemical & Physical Properties Molecular Formula CBr3NO2 Exact Mass 294.747894 PSA 45.82000 Index of Refraction 1.658 InChIKey QQZIUHOKWDFXEY-UHFFFAOYSA-N SMILES O=[N+]([O-])C(Br)(Br)Br Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : CHEMICAL NAME : Methane, nitrotribromo- CAS REGISTRY NUMBER : BEILSTEIN REFERENCE NO. : LAST UPDATED : DATA ITEMS CITED : MOLECULAR FORMULA : C-Br3-N-O2 MOLECULAR WEIGHT : WISWESSER LINE NOTATION : HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : KHFZAN Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1- 1967- Volume(issue)/page/year: 10(6),53,1976 Safety Information HS Code 2904909090 Synthetic Route nitromethane Tribromonitrome... Trinitrophenol Tribromonitrome... Literature: Groves; Bolas Justus Liebigs Annalen der Chemie, 1870 , vol. 155, p. 253 Trinitrophenol Tetrabromometha... Tribromonitrome... Literature: Hunter Journal of the Chemical Society, 1923 , vol. 123, p. 547 Full Text Show Details Archetti Chem. Zentralbl., 1904 , vol. 75, # I p. 23 Precursor & DownStream Precursor 9 CAS#:75-52-5 nitromethane CAS#:88-89-1 Trinitrophenol CAS#:52-51-7 CAS#:73730-97-9 5-bromo-6-hydro... DownStream 10 CAS#:598-91-4 Dibromo(nitro)m... CAS#:506-68-3 Cyanogen bromide CAS#:103-19-5 para-Tolyl disulfide CAS#:52-51-7 |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 5.5% Ordinary tariff: 30.0% |
| Transport Info | Product name: Summary HS:2904909090 sulphonated, nitrated or nitrosated derivatives of hydrocarbons, whether or not halogenated VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0% |
| Related Products in Specialty Chemicals | ||
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| 1,5-Diaminopentane | 462-94-2 | 2A-9022055 |
| Diethoxymethane | 462-95-3 | 2A-9022056 |
| Pentyl nitrite | 463-04-7 | 2A-9022057 |
| Linolenic acid | 463-40-1 | 2A-9022058 |
| Thiophosgene | 463-71-8 | 2A-9022059 |
| (-)-Camphor | 464-48-2 | 2A-9022064 |
| D(+)-Camphor | 464-49-3 | 2A-9022065 |
| Benzopinacole | 464-72-2 | 2A-9022066 |
| Ketopinic acid | 464-78-8 | 2A-9022067 |
| Gamabufotalin | 465-11-2 | 2A-9022070 |
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