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Molecule
Ammonium Chlorate
CAS: 10192-29-7 · H4ClNO3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 10192-29-7
- Molecular Formula
- H4ClNO3
- Molecular Mass
- 101.49 g/mol
Identifiers
CAS Registry Number
10192-29-7
SMILES
N.[O-][Cl+2]([O-])O
InChI Key
KHPLPBHMTCTCHA-UHFFFAOYSA-N
InChI
InChI=1S/ClHO3.H3N/c2-1(3)4;/h(H,2,3,4);1H3
Names and Synonyms
- Ammonium Chlorate Synonym
- Chloric acid, ammonium salt Synonym
- Ammonium chlorate Synonym
- Ammonium chlorate (NH4ClO3) Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 101.49 g/mol | CAS Common Chemistry |
| 101.48899999999999 g/mol | RDKit | |
| 101.489 g/mol | RDKit | |
| 101.486 g/mol | chempirical lib | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Ammonium_chlorate | CAS Common Chemistry |
| Canonical SMILES | O=Cl(=O)O.N | CAS Common Chemistry |
| InChI | InChI=1S/ClHO3.H3N/c2-1(3)4;/h(H,2,3,4);1H3 | CAS Common Chemistry |
| InChI Key | InChIKey=KHPLPBHMTCTCHA-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Ammonium chlorate | CAS Common Chemistry |
| Heavy Atom Count | 5 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 101.35000000000001 Ų | RDKit |
| 101.35 Ų | RDKit | |
| LogP | -2.773 | RDKit |
| Molar Refractivity | 7.2409 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 100.987970668 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 |
|---|
200 ppm
180
160
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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MW = 101.49 g/mol. Edit any field — others recompute live.
