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Copper Formate
CAS: 544-19-4 | CH2CuO2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
544-19-4
Molecular Formula:
CH2CuO2
Molecular Weight:
109.571 g/mol
Names and Synonyms:
Copper Formate
Copper formate (Cu(HCOO)2)
Copper(2+) formate
Copper diformate
Formic acid copper(2+) salt (1:1)
Cupric diformate
Copper(II) formate
Tubercuprose
Cupric formate
Copper formate
Formic acid, copper(2+) salt
Formic acid, copper(2+) salt (2:1)
Identifiers:
SMILES:
O=CO.[Cu]
InChI:
InChI=1S/CH2O2.Cu/c2-1-3;/h1H,(H,2,3);
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
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 109.57 g/mol | Legacy Database |
| density | 1.83 g/cm³ | Legacy Database |
| cas-canonical-smile | [Cu].O=CO None | Legacy Database |
| cas-density | 1.831 g/cm3 None | Legacy Database |
| cas-inchi | InChI=1S/CH2O2.Cu/c2-1-3;/h1H,(H,2,3); None | Legacy Database |
| cas-inchi-key | InChIKey=BJYLNGGDLHKELP-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Copper formate None | Legacy Database |
| LogP | -0.3016999999999999 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 109.571 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 108.935076804 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 4 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 1 count | RDKit |
| Hydrogen Bond Donors | 1 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 37.3 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 8.6928 | RDKit |
