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
-3.2126 -0.3907 -0.1936 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9883 0.3119 0.3201 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8178 -0.3644 -0.1971 N 0 0 0 0 0 0 0 0 0 0 0 0
0.5005 0.1116 0.1462 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5375 1.1116 0.8937 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6256 -0.5540 -0.3625 N 0 0 0 0 0 0 0 0 0 0 0 0
2.9463 -0.1646 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3533 0.8276 0.6542 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0527 0.3544 -0.1877 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4809 -1.2914 0.3962 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0067 -0.7042 -1.2377 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9024 0.3026 1.4259 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9765 1.3354 -0.1036 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8659 -1.1882 -0.8127 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4942 -1.4029 -0.9962 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7319 -0.7946 -0.5628 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4246 1.0159 0.7846 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6898 1.4840 1.1515 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