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
-3.2626 -0.2118 -0.1984 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8404 -0.2316 -0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8961 0.0048 0.3351 N 0 0 0 0 0 0 0 0 0 0 0 0
0.5056 0.0241 0.0408 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9067 -0.1646 -1.1305 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4352 0.2591 1.0890 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8343 0.3055 0.9473 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5375 0.1474 -0.1391 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6984 0.8051 -0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2607 -0.5428 0.8757 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8390 -0.9530 -0.7901 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6420 -1.2121 -1.2251 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7219 0.5341 -1.5379 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2086 0.1628 1.3088 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0051 0.4105 2.0595 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3950 0.4997 1.8731 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6422 0.2092 -0.1103 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1080 -0.0465 -1.1012 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