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
-2.6649 -0.7376 0.0793 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2191 0.5634 0.7175 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9344 0.9044 0.0878 N 0 0 0 0 0 0 0 0 0 0 0 0
0.1745 0.0260 0.1847 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1413 -1.0687 0.7940 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3885 0.4029 -0.4402 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5105 -0.4612 -0.3556 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6391 -0.1121 -0.9359 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4427 -0.5356 -0.6963 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8332 -1.2486 -0.4442 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1172 -1.3570 0.8558 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9400 1.3686 0.4803 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0613 0.4444 1.8146 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8232 1.7957 -0.4375 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4526 1.3221 -0.9643 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4825 -1.4002 0.1668 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7209 0.8199 -1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5259 -0.7264 -0.9065 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