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Maleic Hydrazide
CAS: 123-33-1 | C4H4N2O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
123-33-1
Molecular Formula:
C4H4N2O2
Molecular Weight:
112.08800000000001 g/mol
Names and Synonyms:
Maleic Hydrazide
3,6-Pyridazinedione, 1,2-dihydro-
3(2H)-Pyridazinone, 6-hydroxy-
1,2-Dihydro-3,6-pyridazinedione
MAH
Maleic hydrazide
MH
Malzid
3,6-Pyridazinediol
6-Hydroxy-3(2H)-pyridazinone
3,6-Dihydroxypyridazine
3,6-Dioxopyridazine
Maleic acid cyclic hydrazide
Regulox 36
Antyrost
Antergon
Malepin
Mazide
Super De-Sprout
Maleic cyclic hydrazide
Sorbatran
MH (hydrazide)
Royal Slo-Gro
Yadi
Yake
NSC 13892
NSC 234167
NSC 48832
NSC 8823
1,2,3,6-Tetrahydropyridazine-3,6-dione
Identifiers:
SMILES:
Oc1ccc(O)nn1
InChI:
InChI=1S/C4H4N2O2/c7-3-1-2-4(8)6-5-3/h1-2H,(H,5,7)(H,6,8)
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 | 112.09 g/mol | Legacy Database |
| density | 1.60 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Maleic_hydrazide None | Legacy Database |
| cas-canonical-smile | O=C1C=CC(=O)NN1 None | Legacy Database |
| cas-density | 1.60 g/cm3 @ Temp: 25 °C None | Legacy Database |
| cas-inchi | InChI=1S/C4H4N2O2/c7-3-1-2-4(8)6-5-3/h1-2H,(H,5,7)(H,6,8) None | Legacy Database |
| cas-inchi-key | InChIKey=BGRDGMRNKXEXQD-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 298-300 °C None | Legacy Database |
| cas-name | Maleic hydrazide None | Legacy Database |
| wikipedia-name | Maleic hydrazide None | Legacy Database |
| LogP | -0.11219999999999991 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 112.08800000000001 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 112.027277368 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 8 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 4 count | RDKit |
| Hydrogen Bond Donors | 2 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 1 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 66.24000000000001 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 25.361599999999996 | RDKit |
