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Urea, Polymer With Formaldehyde And 2-Methylpropanal
CAS: 28931-47-7 | C6H14N2O3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
28931-47-7
Molecular Formula:
C6H14N2O3
Molecular Mass:
162.19 g/mol
Names and Synonyms:
Urea, Polymer With Formaldehyde And 2-Methylpropanal
Urea, polymer with formaldehyde and 2-methylpropanal
Urea condensation products, with formaldehyde and isobutyraldehyde
Isobutyraldehyde, polymer with formaldehyde and urea
Propanal, 2-methyl-, polymer with formaldehyde and urea
Formaldehyde, polymer with 2-methylpropanal and urea
Formaldehyde-isobutyraldehyde-urea copolymer
Formaldehyde-isobutylaldehyde-urea polymer
Isobutyraldehyde-formaldehyde-urea copolymer
Urea-isobutylaldehyde-formaldehyde copolymer
Urea-isobutyraldehyde-formaldehyde copolymer
UFIR
Laropal A 81
A 81
Laromer PA 9013
Formaldehyde-isobutylaldehyde-urea copolymer
LP-A 81
KX-A 81
Identifiers:
SMILES:
C=O.CC(C)C=O.N=C(N)O
InChI:
InChI=1S/C4H8O.CH4N2O.CH2O/c1-4(2)3-5;2-1(3)4;1-2/h3-4H,1-2H3;(H4,2,3,4);1H2
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 | 162.19 g/mol | CAS Common Chemistry |
| 162.189 g/mol | RDKit | |
| 162.100442308 g/mol | RDKit | |
| Canonical SMILES | O=C.O=CC(C)C.O=C(N)N | CAS Common Chemistry |
| InChI | InChI=1S/C4H8O.CH4N2O.CH2O/c1-4(2)3-5;2-1(3)4;1-2/h3-4H,1-2H3;(H4,2,3,4);1H2 | CAS Common Chemistry |
| InChI Key | InChIKey=ZMIUNFJAYFDIED-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Urea, polymer with formaldehyde and 2-methylpropanal | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 3 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 104.24000000000001 Ų | RDKit |
| LogP | 0.09426999999999991 | RDKit |
| Molar Refractivity | 42.5659 | RDKit |
