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
3.2709 -0.0926 -0.0735 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9213 0.5815 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8835 -0.4367 -0.0856 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.4794 0.0485 -0.1464 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7155 1.2751 -0.2473 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5750 -0.8500 -0.0933 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.9424 -0.5051 -0.1431 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4559 0.6794 -0.2452 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0110 0.5494 0.4609 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1283 -1.0533 0.4658 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6575 -0.3512 -1.0842 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8098 1.2612 -0.9917 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8101 1.2011 0.7863 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0772 -1.4489 -0.0023 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2815 -1.8726 -0.0076 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6266 -1.3805 -0.0851 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5518 0.7813 -0.2713 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9415 1.6133 -0.3106 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