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
2.5724 -0.0463 0.2697 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6352 0.8293 -0.0724 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5410 0.4246 -0.8224 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7288 0.3748 -0.1716 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8148 -0.0749 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6577 -0.6358 0.9712 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4341 0.2337 0.8508 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5095 -1.0861 -0.0232 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7490 1.8526 0.2467 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9899 1.3673 0.2573 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3530 -0.4109 -2.0586 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3741 -0.9640 -0.7149 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5444 0.7427 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3112 -0.5744 1.5032 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5147 -0.3928 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7749 -1.6400 0.4883 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