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
-2.7698 0.7637 0.1954 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2663 -0.5786 -0.2539 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9319 -0.8712 0.1087 N 0 0 0 0 0 0 0 0 0 0 0 0
0.1942 -0.0917 -0.2971 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0860 0.9100 -1.0254 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5216 -0.4091 0.0819 N 0 0 0 0 0 0 0 0 0 0 0 0
2.6079 0.3938 -0.3449 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8586 0.1495 -0.0257 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8793 0.7156 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4865 1.5842 -0.5125 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5038 1.0014 1.2453 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9467 -1.3370 0.1838 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4165 -0.6223 -1.3607 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7221 -1.6961 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6681 -1.2483 0.6815 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4055 1.2600 -0.9699 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6688 0.7700 -0.3591 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0844 -0.6940 0.5863 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