| CAS Number | 75381-80-5 |
| Catalog Number | AG003OBD(AGN-PC-0U76VE) |
| Chemical Name | Bis(dimethylacetamide)hydrogen tribromide |
| InChI | InChI=1S/2C4H9NO.Br3/c2*1-4(6)5(2)3;1-3-2/h2*1-3H3;/q;;-1/p+1 |
| InChI Key | ZCEJJOHOOPDXSZ-UHFFFAOYSA-O |
| MDL Number | MFCD08276280 |
| Molecular Formula | C8H19Br3N2O2 |
| Molecular Weight | 414.9607 |
| SMILES | O=C(C)N(C)C.Br[BrH]Br.O=C(C)N(C)C |
| Synonyms | 75381-80-5,
Bis(N,N-dimethylacetamide) Hydrogen Dibromobromate,
DTXSID90659763,
PUBCHEM_44629803,
MFCD08276280,
B2509,
Bis(N,N-dimethylacetamide) Hydrogen Tribromide,
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| Complexity | 58.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 4 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 413.898g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 414.964g/mol |
| Monoisotopic Mass | 411.9g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 40.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H315-H319
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Packing Group
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Precautionary statements
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P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
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UN Code
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Certificate of Analysis
Lot Number