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N-NBM
CAS: 924-42-5 | C4H7NO2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
924-42-5
Molecular Formula:
C4H7NO2
Molecular Weight:
101.10499999999999 g/mol
Names and Synonyms:
N-NBM
N-Methylolacrylamide
2-Propenamide, N-(hydroxymethyl)-
Acrylamide, N-(hydroxymethyl)-
N-(Hydroxymethyl)-2-propenamide
N-Methylolacrylamide
N-Methanolacrylamide
N-(Hydroxymethyl)acrylamide
Monomethylolacrylamide
NMA 60
MH 100 (amide)
MH 100
N-MAM P
U-Ramin T 80
Rocagil BT
N-MAM
NSC 553
Cylink NMA
N-Methylol acrylamide
NMA 48
Identifiers:
SMILES:
C=CC(O)=NCO
InChI:
InChI=1S/C4H7NO2/c1-2-4(7)5-3-6/h2,6H,1,3H2,(H,5,7)
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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 101.10499999999999 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 101.047678464 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 7 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 2 count | RDKit |
| Hydrogen Bond Donors | 2 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 2 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 52.82000000000001 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 0.07869999999999999 | RDKit |
| molecular_mass | 101.10 g/mol | Legacy Database |
| cas-canonical-smile | O=C(C=C)NCO None | Legacy Database |
| cas-inchi | InChI=1S/C4H7NO2/c1-2-4(7)5-3-6/h2,6H,1,3H2,(H,5,7) None | Legacy Database |
| cas-inchi-key | InChIKey=CNCOEDDPFOAUMB-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 74.5 °C None | Legacy Database |
| cas-name | N-Methylolacrylamide None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 27.34659999999999 | RDKit |
