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Ammonium Bromide
CAS: 12124-97-9 | H4BrN
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
12124-97-9
Molecular Formula:
H4BrN
Molecular Mass:
97.94 g/mol
Names and Synonyms:
Ammonium Bromide
Ammonium bromide ((NH4)Br)
Ammonium bromide
Hydrobromic acid monoammoniate
Spectrum XD 3899
Fuzzicide
Flovan BU
Flamex PA
Identifiers:
SMILES:
Br.N
InChI:
InChI=1S/BrH.H3N/h1H;1H3
Key Properties
Density
2.43 g/cm³
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
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80
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40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 97.94 g/mol | CAS Common Chemistry |
| 97.943 g/mol | RDKit | |
| 96.952711228 g/mol | RDKit | |
| Density | 2.43 g/cm³ | CAS Common Chemistry |
| 2.429 g/cm3 @ Temp: 25 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Ammonium_bromide | CAS Common Chemistry |
| Canonical SMILES | Br[NH4] | CAS Common Chemistry |
| InChI | InChI=1S/BrH.H3N/h1H;1H3 | CAS Common Chemistry |
| InChI Key | InChIKey=SWLVFNYSXGMGBS-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Ammonium bromide | CAS Common Chemistry |
| Heavy Atom Count | 2 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 35.0 Ų | RDKit |
| LogP | 0.7399 | RDKit |
| Molar Refractivity | 15.3441 | RDKit |
