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
-3.2361 0.1150 -0.3308 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8764 0.7496 -0.2079 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8892 -0.3136 -0.2353 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4951 0.0602 -0.1309 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7875 1.2689 -0.0222 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4765 -0.9533 -0.1549 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8631 -0.7386 -0.0625 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4824 0.4044 0.0589 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0426 0.7028 0.1444 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4118 -0.0540 -1.4221 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1951 -0.8777 0.1763 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7439 1.4722 -1.0353 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8171 1.3297 0.7447 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1622 -1.3330 -0.3283 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1423 -1.9604 -0.2503 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5398 -1.6243 -0.0934 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5810 0.4049 0.1191 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0068 1.3472 0.1052 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