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2-[[(Butylamino)Carbonyl]Oxy]Ethyl 2-Propenoate
CAS: 63225-53-6 | C10H17NO4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
63225-53-6
Molecular Formula:
C10H17NO4
Molecular Mass:
215.25 g/mol
Names and Synonyms:
2-[[(Butylamino)Carbonyl]Oxy]Ethyl 2-Propenoate
2-Propenoic acid, 2-[[(butylamino)carbonyl]oxy]ethyl ester
2-[[(Butylamino)carbonyl]oxy]ethyl 2-propenoate
1-Butanecarbamic acid 2-acryloyloxyethyl ester
2-(Acryloyloxy)ethyl N-butylcarbamate
2-Acryloyloxyethyl butylcarbamate
Genomer 1122
Ebecryl 1029
Ebecryl 1040
Ebecryl CL 1039
2-[[(Butylamino)carbonyl]oxy]ethyl acrylate
2-(N-Butylcarbamoyloxy)ethyl acrylate
Genomer 122
Photomer 4184
G 1122
2-(Butylcarbamoyloxy)ethyl acrylate
EM 2080
2-((Butylcarbamoyl)oxy)ethyl acrylate
Viscoat 216
Identifiers:
SMILES:
C=CC(=O)OCCOC(O)=NCCCC
InChI:
InChI=1S/C10H17NO4/c1-3-5-6-11-10(13)15-8-7-14-9(12)4-2/h4H,2-3,5-8H2,1H3,(H,11,13)
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 | 215.25 g/mol | CAS Common Chemistry |
| 215.24899999999997 g/mol | RDKit | |
| 215.115758024 g/mol | RDKit | |
| Canonical SMILES | O=C(OCCOC(=O)NCCCC)C=C | CAS Common Chemistry |
| InChI | InChI=1S/C10H17NO4/c1-3-5-6-11-10(13)15-8-7-14-9(12)4-2/h4H,2-3,5-8H2,1H3,(H,11,13) | CAS Common Chemistry |
| InChI Key | InChIKey=FLKHVLRENDBIDB-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 2-[[(Butylamino)carbonyl]oxy]ethyl 2-propenoate | CAS Common Chemistry |
| Heavy Atom Count | 15 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 7 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 68.12 Ų | RDKit |
| LogP | 1.4463000000000001 | RDKit |
| Molar Refractivity | 56.94680000000003 | RDKit |
