Monomers
Propane, 2-(ethenyloxy)-
Identifiers
IUPAC name
2-ethenoxypropane
InchI
InChI=1S/C5H10O/c1-4-6-5(2)3/h4-5H,1H2,2-3H3
InchI Key
GNUGVECARVKIPH-UHFFFAOYSA-N
SMILES
C=COC(C)C
Canonical SMILES
CC(C)OC=C
Isomeric SMILES
CC(C)OC=C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H10O
Heavy Atom Count
6
Molecular Weight
86.134
Exact Molecular Weight
86.0732
Valence Electrons
36
Radical Electrons
0
tPSA
9.23
MolLogP
1.5549
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
16 15 0 0 0 0 0 0 0 0999 V2000
2.7400 -0.2679 0.0722 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6204 -0.4854 0.7226 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5447 0.3696 0.5944 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4793 0.2392 -0.3513 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4452 1.4049 -0.1192 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3043 -1.0286 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8532 0.5990 -0.5915 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6098 -0.8997 0.1337 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5287 -1.3379 1.3665 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1347 0.2986 -1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3017 1.2486 -0.7763 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9317 2.3812 -0.2721 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7780 1.3190 0.9361 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4044 -1.1239 0.9799 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8182 -1.8976 -0.5719 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2995 -0.8191 -0.5972 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 1 0
4 5 1 0
4 6 1 0
1 7 1 0
1 8 1 0
2 9 1 0
4 10 1 0
5 11 1 0
5 12 1 0
5 13 1 0
6 14 1 0
6 15 1 0
6 16 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers