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
-2.7990 0.2804 0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1291 -1.0352 0.1572 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7248 -1.0414 0.4530 N 0 0 0 0 0 0 0 0 0 0 0 0
0.1634 -0.1043 -0.1712 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2951 0.7300 -0.9852 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5567 -0.0960 0.1098 N 0 0 0 0 0 0 0 0 0 0 0 0
2.3856 0.8586 -0.5417 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6784 0.8772 -0.2904 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6855 0.5137 1.5843 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4040 1.1311 -0.0598 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8956 0.1158 0.3471 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6170 -1.8062 0.7962 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3537 -1.2674 -0.9002 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2962 -1.7329 1.1377 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9690 -0.7775 0.7826 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9797 1.5676 -1.2368 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1499 0.1890 0.4004 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3174 1.5974 -0.7791 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