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Molecule
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
Identifiers
CAS Registry Number
12124-97-9
SMILES
Br.N
InChI Key
SWLVFNYSXGMGBS-UHFFFAOYSA-N
InChI
InChI=1S/BrH.H3N/h1H;1H3
Names and Synonyms
- Ammonium Bromide Common Name
- Ammonium bromide ((NH4)Br) Synonym
- Ammonium bromide Synonym
- Hydrobromic acid monoammoniate Synonym
- Spectrum XD 3899 Synonym
- Fuzzicide Synonym
- Flovan BU Synonym
- Flamex PA Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 97.94 g/mol | CAS Common Chemistry |
| 97.943 g/mol | RDKit | |
| Density | 2.43 g/cm³ | CAS Common Chemistry |
| 2.429 g/cm3 @ 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 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 96.952711228 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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| 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.
External Resources
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Quick conversion
MW = 97.94 g/mol; density = 2.430 g/mL. Edit any field — others recompute live.
