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Succinamide
CAS: 110-14-5 | C4H8N2O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
110-14-5
Molecular Formula:
C4H8N2O2
Molecular Mass:
116.12 g/mol
Names and Synonyms:
Succinamide
Butanediamide
Succinamide
Succindiamide
Succinic amide
Succinic acid diamide
T 152
NSC 8157
T 152 (emulsifier)
Identifiers:
SMILES:
N=C(O)CCC(=N)O
InChI:
InChI=1S/C4H8N2O2/c5-3(7)1-2-4(6)8/h1-2H2,(H2,5,7)(H2,6,8)
Key Properties
Melting Point
268 °C (decomp)
CAS Common Chemistry
Density
1.44 g/cm³
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 | 116.12 g/mol | CAS Common Chemistry |
| 116.11999999999999 g/mol | RDKit | |
| 116.058577496 g/mol | RDKit | |
| Density | 1.44 g/cm³ | CAS Common Chemistry |
| 1.442 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | O=C(N)CCC(=O)N | CAS Common Chemistry |
| InChI | InChI=1S/C4H8N2O2/c5-3(7)1-2-4(6)8/h1-2H2,(H2,5,7)(H2,6,8) | CAS Common Chemistry |
| InChI Key | InChIKey=SNCZNSNPXMPCGN-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 268 °C (decomp) | CAS Common Chemistry |
| Name | Succinamide | CAS Common Chemistry |
| Heavy Atom Count | 8 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 4 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 88.16000000000001 Ų | RDKit |
| LogP | 0.83714 | RDKit |
| Molar Refractivity | 29.944999999999997 | RDKit |
