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2-Hydroxyacetamide
CAS: 598-42-5 | C2H5NO2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
598-42-5
Molecular Formula:
C2H5NO2
Molecular Mass:
75.07 g/mol
Names and Synonyms:
2-Hydroxyacetamide
Acetamide, 2-hydroxy-
Glycolamide
2-Hydroxyacetimidic acid
Glycolic acid amide
Glycolic amide
2-Hydroxyacetamide
NSC 97323
Identifiers:
SMILES:
N=C(O)CO
InChI:
InChI=1S/C2H5NO2/c3-2(5)1-4/h4H,1H2,(H2,3,5)
Key Properties
Melting Point
120 °C
CAS Common Chemistry
Density
1.42 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 | 75.07 g/mol | CAS Common Chemistry |
| 75.067 g/mol | RDKit | |
| 75.0320284 g/mol | RDKit | |
| Density | 1.42 g/cm³ | CAS Common Chemistry |
| 1.415 g/cm3 @ Temp: -5 °C | CAS Common Chemistry | |
| Canonical SMILES | O=C(N)CO | CAS Common Chemistry |
| InChI | InChI=1S/C2H5NO2/c3-2(5)1-4/h4H,1H2,(H2,3,5) | CAS Common Chemistry |
| InChI Key | InChIKey=TZGPACAKMCUCKX-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 120 °C | CAS Common Chemistry |
| Name | 2-Hydroxyacetamide | CAS Common Chemistry |
| Heavy Atom Count | 5 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 3 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 64.31 Ų | RDKit |
| LogP | -0.48602999999999996 | RDKit |
| Molar Refractivity | 17.4413 | RDKit |
