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
2.3017 1.1029 0.2343 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2098 -0.4036 0.4744 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8888 -0.6789 0.9388 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.2605 -0.3639 0.1359 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0279 0.1538 -0.9673 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5691 -0.6146 0.5478 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.7455 -0.3549 -0.1376 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7984 0.1876 -1.3236 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6561 1.5850 0.9929 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9466 1.3930 -0.7527 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3494 1.4302 0.4007 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4634 -0.9136 -0.4774 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9425 -0.6174 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7481 -1.1116 1.8657 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6506 -1.0643 1.5183 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7105 -0.6106 0.3203 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9707 0.5090 -1.9388 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7732 0.3719 -1.8244 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