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
-1.7263 0.8215 1.7709 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1232 1.7787 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7206 1.1120 -0.4472 N 0 0 0 0 0 0 0 0 0 0 0 0
0.2495 0.0729 -0.4285 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7969 -0.3089 0.6368 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6269 -0.5677 -1.6403 N 0 0 0 0 0 0 0 0 0 0 0 0
1.5604 -1.6006 -1.7916 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2679 -2.1788 -0.8518 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8086 0.7272 1.4999 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2646 -0.1800 1.7308 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6653 1.2368 2.7934 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2701 2.2827 1.2854 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8746 2.5543 0.5657 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1438 1.3927 -1.3456 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1416 -0.2181 -2.5271 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7358 -1.9869 -2.8116 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2503 -1.9560 0.1996 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9679 -2.9820 -1.1130 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