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
-2.8120 0.3533 0.1313 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1539 -0.9938 -0.0478 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8086 -0.8741 -0.5753 N 0 0 0 0 0 0 0 0 0 0 0 0
0.1843 -0.1473 0.1428 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0634 0.4099 1.2441 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5099 -0.0203 -0.3612 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5311 0.6875 0.3084 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7292 0.7598 -0.2206 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1078 1.1665 0.3308 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3923 0.6458 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5648 0.2415 0.9389 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7968 -1.5736 -0.7398 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1645 -1.5785 0.9188 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6030 -1.3354 -1.4874 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6946 -0.4926 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3450 1.1703 1.2472 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9406 0.2854 -1.1588 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5324 1.2957 0.2699 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