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
-2.5231 0.6459 0.9166 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1748 -0.4671 -0.0251 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8927 -1.0438 0.1905 N 0 0 0 0 0 0 0 0 0 0 0 0
0.3075 -0.2865 0.1045 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1916 0.9128 -0.1695 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5885 -0.8284 0.3123 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8091 -0.1529 0.2459 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0498 1.0885 -0.0131 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1798 0.4896 1.9429 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6306 0.7236 0.9481 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1677 1.6203 0.4762 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9847 -1.2157 -0.0036 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1851 -0.0367 -1.0558 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8460 -2.0596 0.4191 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5988 -1.8687 0.5438 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7082 -0.7779 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2739 1.7932 -0.2225 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0570 1.4635 -0.0275 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