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Molecule

Caesium Bromide

CAS: 7787-69-1 · BrCs

2D Structure

3D Structure

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Basic Information

CAS Registry Number
7787-69-1
Molecular Formula
BrCs
Molecular Mass
212.81 g/mol

Identifiers

CAS Registry Number

7787-69-1

SMILES

[Br-].[Cs+]

InChI Key

LYQFWZFBNBDLEO-UHFFFAOYSA-M

InChI

InChI=1S/BrH.Cs/h1H;/q;+1/p-1

Names and Synonyms

  • Caesium Bromide Common Name
  • Cesium bromide (CsBr) Synonym
  • Cesium bromide Synonym
  • Cesium monobromide Synonym
  • NSC 84269 Synonym

All Properties

Comprehensive physical and chemical properties

Property Value Source
Molecular Mass 212.81 g/mol CAS Common Chemistry
212.809 g/mol RDKit
214.825 g/mol chempirical lib
Wikipedia Url https://en.wikipedia.org/wiki/Caesium_bromide CAS Common Chemistry
Canonical SMILES Br[Cs] CAS Common Chemistry
InChI InChI=1S/BrH.Cs/h1H;/q;+1/p-1 CAS Common Chemistry
InChI Key InChIKey=LYQFWZFBNBDLEO-UHFFFAOYSA-M CAS Common Chemistry
Melting Point 636 °C CAS Common Chemistry
Name Cesium bromide CAS Common Chemistry
Heavy Atom Count 2 RDKit
Hydrogen Bond Acceptors 0 RDKit
Hydrogen Bond Donors 0 RDKit
Rotatable Bonds 0 RDKit
Aromatic Ring Count 0 RDKit
Topological Polar Surface Area 0.0 Ų RDKit
LogP -5.992 RDKit
Molar Refractivity 0.0 cm³/mol RDKit
Ring Count 0 RDKit
Formal Charge 0 RDKit
Fraction Csp3 0.0 RDKit
Exact Mass 211.823789 g/mol RDKit

Spectral Data

NMR, IR, and Mass spectral data

Predicting NMR spectra...
10 ppm 9 8 7 6 5 4 3 2 1 0 ppm
Shift (ppm) Multiplicity Integration Assignment

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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MW = 212.81 g/mol. Edit any field — others recompute live.

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