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N-[3-(Dimethylamino)Propyl]Acrylamide
CAS: 3845-76-9 | C8H16N2O
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
3845-76-9
Molecular Formula:
C8H16N2O
Molecular Mass:
156.23 g/mol
Names and Synonyms:
N-[3-(Dimethylamino)Propyl]Acrylamide
2-Propenamide, N-[3-(dimethylamino)propyl]-
Acrylamide, N-[3-(dimethylamino)propyl]-
N-[3-(Dimethylamino)propyl]-2-propenamide
3-(N,N-Dimethylaminopropyl)acrylamide
N-[3-(Dimethylamino)propyl]acrylamide
Dimethyl(3-acrylamidopropyl)amine
Acrylamidopropyldimethylamine
[3-(Acryloylamino)propyl]dimethylamine
Acrylamido-3-N,N-dimethylpropylamine
DMAPAA
N-[3-(N,N-Dimethylamino)propyl]acrylamide
DMAPAA-MHQ
Identifiers:
SMILES:
C=CC(O)=NCCCN(C)C
InChI:
InChI=1S/C8H16N2O/c1-4-8(11)9-6-5-7-10(2)3/h4H,1,5-7H2,2-3H3,(H,9,11)
Key Properties
Boiling Point
106-108 °C @ Press: 1 Torr
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 | 156.23 g/mol | CAS Common Chemistry |
| 156.229 g/mol | RDKit | |
| 156.126263132 g/mol | RDKit | |
| Boiling Point | 106-108 °C @ Press: 1 Torr | CAS Common Chemistry |
| Canonical SMILES | O=C(C=C)NCCCN(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C8H16N2O/c1-4-8(11)9-6-5-7-10(2)3/h4H,1,5-7H2,2-3H3,(H,9,11) | CAS Common Chemistry |
| InChI Key | InChIKey=ADTJPOBHAXXXFS-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | N-[3-(Dimethylamino)propyl]acrylamide | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 5 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 35.830000000000005 Ų | RDKit |
| LogP | 1.0806 | RDKit |
| Molar Refractivity | 48.29880000000003 | RDKit |
