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Molecule
Calcium Chloride
CAS: 10043-52-4 · CaCl2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 10043-52-4
- Molecular Formula
- CaCl2
- Molecular Mass
- 110.98 g/mol
Identifiers
CAS Registry Number
10043-52-4
SMILES
[Ca+2].[Cl-].[Cl-]
InChI Key
UXVMQQNJUSDDNG-UHFFFAOYSA-L
InChI
InChI=1S/Ca.2ClH/h;2*1H/q+2;;/p-2
Names and Synonyms
- Calcium Chloride Common Name
- Calcium chloride (CaCl2) Synonym
- Calcium chloride Synonym
- Calcium dichloride Synonym
- Calcosan Synonym
- Liquidow Synonym
- Stopit Synonym
- U-Ramin MC Synonym
- Calcium(2+) chloride Synonym
- Daraccel Synonym
- Dowflake Synonym
- Peladow Synonym
- Calol Synonym
- Calzina oral Synonym
- Bovikalc Synonym
- Chrysoxel C 4 Synonym
- Calmate R Synonym
- CalPlus Synonym
- Intergravin-orales Synonym
- Kalgan Synonym
- Briners Choice Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 110.98 g/mol | CAS Common Chemistry |
| 110.98400000000001 g/mol | RDKit | |
| 110.984 g/mol | RDKit | |
| 115.01 g/mol | chempirical lib | |
| Density | 2.15 g/cm³ | CAS Common Chemistry |
| 2.152 g/cm3 @ 15 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Calcium_chloride | CAS Common Chemistry |
| Boiling Point | 1670 °C | CAS Common Chemistry |
| Canonical SMILES | Cl[Ca]Cl | CAS Common Chemistry |
| InChI | InChI=1S/Ca.2ClH/h;2*1H/q+2;;/p-2 | CAS Common Chemistry |
| InChI Key | InChIKey=UXVMQQNJUSDDNG-UHFFFAOYSA-L | CAS Common Chemistry |
| Melting Point | 772 °C | CAS Common Chemistry |
| Name | Calcium chloride | CAS Common Chemistry |
| Heavy Atom Count | 3 | 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 | -6.3728 | RDKit |
| Molar Refractivity | 5.754 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 109.90029634000001 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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140
120
100
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40
20
0 ppm
| Shift (ppm) | DEPT | 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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Quick conversion
MW = 110.98 g/mol; density = 2.150 g/mL. Edit any field — others recompute live.
