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Ammonium Phosphate
CAS: 10361-65-6 | H12N3O4P
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
10361-65-6
Molecular Formula:
H12N3O4P
Molecular Mass:
149.09 g/mol
Names and Synonyms:
Ammonium Phosphate
Phosphoric acid, ammonium salt (1:3)
Phosphoric acid, triammonium salt
Ammonium phosphate ((NH4)3PO4)
Ammonium phosphate
Ammonium phosphate tribasic
Triammonium phosphate
Triammonium orthophosphate
Triammonium phosphate ((NH4)3PO4)
Tribasic ammonium phosphate
Identifiers:
SMILES:
N.N.N.O=P(O)(O)O
InChI:
InChI=1S/3H3N.H3O4P/c;;;1-5(2,3)4/h3*1H3;(H3,1,2,3,4)
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
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.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 149.09 g/mol | CAS Common Chemistry |
| 149.08700000000002 g/mol | RDKit | |
| 149.05654249399998 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Ammonium_phosphate | CAS Common Chemistry |
| Canonical SMILES | O=P(O)(O)O.N | CAS Common Chemistry |
| InChI | InChI=1S/3H3N.H3O4P/c;;;1-5(2,3)4/h3*1H3;(H3,1,2,3,4) | CAS Common Chemistry |
| InChI Key | InChIKey=ZRIUUUJAJJNDSS-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Triammonium phosphate | CAS Common Chemistry |
| Ammonium phosphate | CAS Common Chemistry | |
| Heavy Atom Count | 8 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 6 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 182.75999999999996 Ų | RDKit |
| LogP | -0.44260000000000055 | RDKit |
| Molar Refractivity | 29.32920000000001 | RDKit |
