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
-2.7655 0.3901 -0.4998 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2641 -0.1806 0.8016 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9237 -0.7236 0.6884 N 0 0 0 0 0 0 0 0 0 0 0 0
0.1829 0.1010 0.2965 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0788 1.3095 0.0601 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5015 -0.4237 0.1829 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5672 0.4349 -0.2096 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8105 -0.0157 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1815 0.0936 -1.3729 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8344 0.0860 -0.6989 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7819 1.5045 -0.4135 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3507 0.5616 1.6288 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9283 -1.0278 1.0994 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6854 -1.7239 0.8801 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7020 -1.4265 0.3821 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3969 1.4815 -0.4245 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6361 0.6144 -0.6229 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9973 -1.0553 -0.1168 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