| Chemical & Physical Properties | |
|---|---|
| CAS Number | 563-70-2 |
| Catalog No. | 2A-9022931 |
| Chinese Name | 溴代硝基甲烷 |
| Synonyms | MFCD00007401; EINECS 209-258-0; bromo(nitro)methane |
| Molecular Formula | BrCH2NO2 |
| Molecular Weight | 139.94 |
| Purity | 90 |
| Density | 2.07 |
| Boiling Point | 146-148 °C/750 mmHg (lit.) |
| Appearance | liquid |
| Storage Condition | Storage: Seal the container and store it in a seal |
| Packaging | III |
| Application | Bromonitromethane is a halonitromethane that can be used to produce a variety of protected α-bromonitroalkane donors for Umpolung amide synthesis. |
| EINECS | 209-258-0 |
| HTC | 2904909090 |
| PubChem ID | 24855488 |
| MDL Number | MFCD00007401 |
| SMILES | [O-][N+](=O)CBr |
| InChI | 1S/CH2BrNO2/c2-1-3(4)5/h1H2 |
| InChI Key | DNPRVXJGNANVCZ-UHFFFAOYSA-N |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | 5.1 |
| MSDS | msds/22931_1_563_70_2.pdf |
| Bioactivity | Bromonitromethane is a halonitromethane that can be used in production of various protected α-bromo nitroalkane donors for use in Umpolung Amide Synthesis (UmAS)[1][2]. Related Catalog Research Areas >> Cancer Signaling Pathways >> Others >> Others References [1]. Dawn M Makley, et al. Silyl Imine Electrophiles in Enantioselective Catalysis: A Rosetta Stone for Peptide Homologation, Enabling Diverse N-protected Aryl Glycines From Aldehydes in Three Steps. Org Lett. 2014 Jun 6;16(11):3146-9. [2]. Alicia Marsà, et al. In Vitro Studies on the Tumorigenic Potential of the Halonitromethanes Trichloronitromethane and Bromonitromethane. Toxicol In Vitro. 2017 Dec;45(Pt 1):72-80. Chemical & Physical Properties Density 2.07 Boiling Point 146-148 °C (750 mmHg) Molecular Formula CH2BrNO2 Molecular Weight 139.93600 Flash Point 4°C Exact Mass 138.92700 PSA 45.82000 LogP 1.13870 Index of Refraction 1.485-1.495 InChIKey DNPRVXJGNANVCZ-UHFFFAOYSA-N SMILES O=[N+]([O-])CBr |
| Use of | Bromonitromethane is a halonitromethane that can be used in production of various protected α-bromo nitroalkane donors for use in Umpolung Amide Synthesis (UmAS)[1][2]. Properties Name Bromonitromethane Synonym More Synonyms Bromonitromethane Biological Activity Description Bromonitromethane is a halonitromethane that can be used in production of various protected α-bromo nitroalkane donors for use in Umpolung Amide Synthesis (UmAS)[1][2]. Related Catalog Research Areas >> Cancer Signaling Pathways >> Others >> Others References [1]. Dawn M Makley, et al. Silyl Imine Electrophiles in Enantioselective Catalysis: A Rosetta Stone for Peptide Homologation, Enabling Diverse N-protected Aryl Glycines From Aldehydes in Three Steps. Org Lett. 2014 Jun 6;16(11):3146-9. [2]. Alicia Marsà, et al. In Vitro Studies on the Tumorigenic Potential of the Halonitromethanes Trichloronitromethane and Bromonitromethane. Toxicol In Vitro. 2017 Dec;45(Pt 1):72-80. Chemical & Physical Properties Molecular Formula CH2BrNO2 Exact Mass 138.92700 PSA 45.82000 LogP 1.13870 Index of Refraction 1.485-1.495 InChIKey DNPRVXJGNANVCZ-UHFFFAOYSA-N SMILES O=[N+]([O-])CBr |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 5.5% Ordinary tariff: 30.0% |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Dangerous Regulations for land transport: 3139 International Dangerous Regulations for sea transport: 3139 International Dangerous Regulations for air transport: 3139 14.2 United Nations shipping name European Land Transport Dangerous Regulations: OXIDIZING LIQUID, N.O.S. (Bromonitromethane) IMDG Code: OXIDIZING LIQUID, N.O.S. (Bromonitromethane) International air transport hazard regulations: Oxidizing liquid, n.o.s. (Bromonitromethane) 14.3 Transport hazard categories European Land Transport Danger Regulations: 5.1 International Maritime Transport Danger Regulations: 5.1 International Air Transport Danger Regulations: 5.1 14.4 Package group European Dangerous Regulations for land transport: II International Dangerous Regulations for sea transport: II International Dangerous Regulations for air transport: II 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available |
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