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
-2.9945 -0.6064 -1.0336 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7825 -0.9102 -0.1913 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7717 0.0987 -0.4094 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4872 0.0371 0.2803 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6450 -0.9183 1.0580 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4563 1.0430 0.0431 N 0 0 0 0 0 0 0 0 0 0 0 0
2.7119 1.0931 0.6496 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1597 0.2385 1.5022 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7545 -0.0046 -0.5132 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6974 -0.0281 -1.9547 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4559 -1.5677 -1.4003 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3467 -1.8962 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0681 -1.0032 0.8772 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9582 0.8790 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1901 1.8207 -0.6606 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3628 1.9418 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6375 -0.6195 1.8605 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1789 0.4026 1.9046 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