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
-2.7506 0.7610 -0.0862 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1934 -0.2941 0.8342 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7794 -0.2136 1.0173 N 0 0 0 0 0 0 0 0 0 0 0 0
0.1208 -0.3354 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3450 -0.5155 -1.2521 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5247 -0.2526 0.1050 N 0 0 0 0 0 0 0 0 0 0 0 0
2.4612 -0.3652 -0.9542 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7572 -0.2836 -0.7306 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3547 1.5166 0.4745 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9896 1.3139 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4668 0.2906 -0.8099 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7176 -0.2119 1.8029 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4181 -1.3290 0.4612 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4068 -0.0640 1.9797 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8383 -0.1021 1.0903 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1336 -0.5204 -1.9695 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5020 -0.3644 -1.5106 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0841 -0.1281 0.2869 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