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N,N′-1,6-Hexanediylbis[2,2-Dimethylhydrazinecarboxamide]
CAS: 69938-76-7 | C12H28N6O2
2D Structure
3D Structure
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Basic Information
CAS Registry Number:
69938-76-7
Molecular Formula:
C12H28N6O2
Molecular Mass:
288.40 g/mol
Names and Synonyms:
N,N′-1,6-Hexanediylbis[2,2-Dimethylhydrazinecarboxamide]
N,N′-1,6-Hexanediylbis[2,2-dimethylhydrazinecarboxamide]
1,6-Hexamethylenebis(N,N-dimethylsemicarbazide)
1,6-Hexamethylenebis(dimethylsemicarbazide)
HN 130
HN 200
AF 24
Antifade 3000
HK 130
Hydrazinecarboxamide, N,N′-1,6-hexanediylbis[2,2-dimethyl-
Identifiers:
SMILES:
CN(C)NC(O)=NCCCCCCN=C(O)NN(C)C
InChI:
InChI=1S/C12H28N6O2/c1-17(2)15-11(19)13-9-7-5-6-8-10-14-12(20)16-18(3)4/h5-10H2,1-4H3,(H2,13,15,19)(H2,14,16,20)
Key Properties
Melting Point
145-148 °C @ Solvent: Benzene
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
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40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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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 | 288.40 g/mol | CAS Common Chemistry |
| 288.396 g/mol | RDKit | |
| 288.227374136 g/mol | RDKit | |
| Canonical SMILES | O=C(NN(C)C)NCCCCCCNC(=O)NN(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C12H28N6O2/c1-17(2)15-11(19)13-9-7-5-6-8-10-14-12(20)16-18(3)4/h5-10H2,1-4H3,(H2,13,15,19)(H2,14,16,20) | CAS Common Chemistry |
| InChI Key | InChIKey=VETHREXFBVHLJJ-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 145-148 °C @ Solvent: Benzene | CAS Common Chemistry |
| Name | N,N′-1,6-Hexanediylbis[2,2-dimethylhydrazinecarboxamide] | CAS Common Chemistry |
| Heavy Atom Count | 20 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 4 | RDKit |
| Rotatable Bonds | 9 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 95.72 Ų | RDKit |
| LogP | 0.5072000000000016 | RDKit |
| Molar Refractivity | 81.97500000000005 | RDKit |
