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Adipic Acid Dihydrazide
CAS: 1071-93-8 | C6H14N4O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
1071-93-8
Molecular Formula:
C6H14N4O2
Molecular Mass:
174.20 g/mol
Names and Synonyms:
Adipic Acid Dihydrazide
Hexanedioic acid, 1,6-dihydrazide
Adipic acid, dihydrazide
Hexanedioic acid, dihydrazide
Adipic dihydrazide
Adipoyl hydrazide
ADH
Adipoyl dihydrazide
Adipoyldihydrazine
Qualimer ADH
BT 1000Z
BK 1000Z
NSC 29542
NSC 3378
ADH 4S
ADH (hydrazide)
ADH-J
ADH-S
T 2210
Ajicure ADH
Adipic acid dihydrazide
Technicure ADH
Epicure PD 797
Identifiers:
SMILES:
NN=C(O)CCCCC(O)=NN
InChI:
InChI=1S/C6H14N4O2/c7-9-5(11)3-1-2-4-6(12)10-8/h1-4,7-8H2,(H,9,11)(H,10,12)
Key Properties
Melting Point
171 °C @ Solvent: Water
CAS Common Chemistry
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 | 174.20 g/mol | CAS Common Chemistry |
| 174.204 g/mol | RDKit | |
| 174.111675688 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Adipic_acid_dihydrazide | CAS Common Chemistry |
| Canonical SMILES | O=C(NN)CCCCC(=O)NN | CAS Common Chemistry |
| InChI | InChI=1S/C6H14N4O2/c7-9-5(11)3-1-2-4-6(12)10-8/h1-4,7-8H2,(H,9,11)(H,10,12) | CAS Common Chemistry |
| InChI Key | InChIKey=IBVAQQYNSHJXBV-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 171 °C @ Solvent: Water | CAS Common Chemistry |
| Name | Adipic dihydrazide | CAS Common Chemistry |
| Adipic acid dihydrazide | CAS Common Chemistry | |
| Heavy Atom Count | 12 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 4 | RDKit |
| Rotatable Bonds | 5 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 117.22 Ų | RDKit |
| LogP | 0.20719999999999988 | RDKit |
| Molar Refractivity | 46.97040000000001 | RDKit |
