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
-2.3839 1.1425 -0.2649 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2453 -0.2669 0.2913 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0519 -0.9043 -0.1835 N 0 0 0 0 0 0 0 0 0 0 0 0
0.2438 -0.3534 0.0811 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3143 0.7040 0.7404 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4322 -0.9665 -0.3781 N 0 0 0 0 0 0 0 0 0 0 0 0
2.7322 -0.5170 -0.1773 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1260 0.5449 0.4646 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1066 1.8950 0.5203 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6541 1.2836 -1.0814 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4224 1.3711 -0.5455 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2451 -0.2520 1.4071 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1270 -0.8523 -0.0394 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0968 -1.7853 -0.7336 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2646 -1.8612 -0.9293 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5394 -1.1414 -0.6199 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4597 1.2319 0.9376 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2210 0.7272 0.5104 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