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
-2.8553 0.3134 -0.2759 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5822 0.6236 -0.1851 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6305 -0.2691 -0.6339 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5895 -0.3877 0.0741 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2636 0.9697 0.0582 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5104 -1.4031 -0.5179 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6477 0.9830 0.0639 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2022 -0.6241 -0.6927 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2861 1.5661 0.2361 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3514 -0.6543 1.1294 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6897 1.6140 0.7423 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1613 1.3765 -0.9707 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3223 0.8389 0.3592 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9972 -2.3422 -0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2697 -1.6625 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0490 -0.9422 -1.3808 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