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
-2.5001 0.3315 0.8003 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0155 0.7962 -0.5547 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8909 0.0500 -1.0267 N 0 0 0 0 0 0 0 0 0 0 0 0
0.3416 0.0232 -0.2722 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3904 0.6710 0.8010 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4161 -0.7131 -0.7606 N 0 0 0 0 0 0 0 0 0 0 0 0
2.6787 -0.8442 -0.1543 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9955 -0.2727 0.9696 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9309 -0.5488 1.1658 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5666 0.0199 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4161 1.1770 1.5156 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8081 1.9060 -0.5293 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8564 0.6828 -1.2663 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9646 -0.4752 -1.9189 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2714 -1.2313 -1.6874 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4417 -1.4705 -0.6675 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3881 0.3504 1.5784 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0257 -0.4521 1.3478 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