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
-3.2464 0.2841 0.0279 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8385 0.8110 0.0703 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9194 -0.3021 -0.0348 N 0 0 0 0 0 0 0 0 0 0 0 0
0.5069 -0.0194 -0.0146 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8469 1.1679 0.0923 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4501 -1.0334 -0.1109 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8355 -0.8608 -0.1006 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5333 0.2381 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2842 -0.7286 -0.4256 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7206 0.2212 1.0262 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8287 0.9644 -0.6338 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6736 1.3353 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6496 1.5784 -0.7179 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2273 -1.2943 -0.1241 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0709 -2.0280 -0.2002 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4562 -1.7836 -0.1872 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6220 0.2571 -0.0055 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0664 1.1927 0.0860 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