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
-2.0239 0.4696 1.5351 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6447 -0.9634 1.2601 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9729 -1.0120 -0.0197 N 0 0 0 0 0 0 0 0 0 0 0 0
0.2408 -0.2593 -0.1982 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7114 0.4243 0.7326 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8969 -0.3069 -1.4548 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0803 0.3598 -1.8002 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7694 1.1387 -1.0041 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1286 0.6195 1.5353 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5137 1.1036 0.7949 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5973 0.7361 2.5468 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5618 -1.6225 1.2478 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9968 -1.3692 2.0694 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3650 -1.5811 -0.7896 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4295 -0.9129 -2.1932 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4370 0.1978 -2.8307 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5463 1.3837 0.0074 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6931 1.5944 -1.4388 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