Monomers
1-Ethenyl-3-ethylurea
Identifiers
IUPAC name
1-ethenyl-3-ethylurea
InchI
InChI=1S/C5H10N2O/c1-3-6-5(8)7-4-2/h3H,1,4H2,2H3,(H2,6,7,8)
InchI Key
LIOYFPXDFZHOGN-UHFFFAOYSA-N
SMILES
CCNC(=O)NC=C
Canonical SMILES
CCNC(=O)NC=C
Isomeric SMILES
CCNC(=O)NC=C
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H10N2O
Heavy Atom Count
8
Molecular Weight
114.148
Exact Molecular Weight
114.0793
Valence Electrons
46
Radical Electrons
0
tPSA
41.13
MolLogP
0.449
H Bond Acceptors
1
H Bond Donors
2
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
18 17 0 0 0 0 0 0 0 0999 V2000
-2.3260 -1.2296 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1556 0.2483 -0.4586 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8447 0.6880 -0.8259 N 0 0 0 0 0 0 0 0 0 0 0 0
0.2780 0.3623 -0.0155 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0547 -0.3083 1.0029 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5972 0.7729 -0.3355 N 0 0 0 0 0 0 0 0 0 0 0 0
2.7674 0.5205 0.3697 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8586 -0.1543 1.4756 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6198 -1.7570 0.2718 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3454 -1.4081 0.0819 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4044 -1.6873 -1.3928 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5099 0.6907 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8883 0.6100 -1.2349 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6775 1.2518 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6698 1.3431 -1.2317 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7000 0.9331 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9908 -0.5804 1.9365 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8553 -0.2954 1.9578 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 1 0
7 8 2 3
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
3 14 1 0
6 15 1 0
7 16 1 0
8 17 1 0
8 18 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers