Monomers
Phenyl vinyl ether
Identifiers
IUPAC name
ethenoxybenzene
InchI
InChI=1S/C8H8O/c1-2-9-8-6-4-3-5-7-8/h2-7H,1H2
InchI Key
NHOGGUYTANYCGQ-UHFFFAOYSA-N
SMILES
C=COc1ccccc1
Canonical SMILES
C=COC1=CC=CC=C1
Isomeric SMILES
C=COC1=CC=CC=C1
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C8H8O
Heavy Atom Count
9
Molecular Weight
120.151
Exact Molecular Weight
120.0575
Valence Electrons
46
Radical Electrons
0
tPSA
9.23
MolLogP
2.2089
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1
MOL File
RDKit 3D
17 17 0 0 0 0 0 0 0 0999 V2000
3.4993 0.0971 -0.2252 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3098 -0.1012 0.2961 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2759 0.8155 0.0769 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0453 0.4224 -0.0269 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9943 1.3974 -0.2432 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3237 1.0214 -0.3498 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6595 -0.3136 -0.2369 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7189 -1.3014 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3962 -0.9057 0.0836 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2728 -0.6280 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7231 0.9644 -0.8356 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1476 -0.9821 0.8943 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6788 2.4286 -0.3241 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0821 1.7723 -0.5194 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7088 -0.6389 -0.3178 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9651 -2.3493 0.0705 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3442 -1.6990 0.2560 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 2 0
5 6 1 0
6 7 2 0
7 8 1 0
8 9 2 0
9 4 1 0
1 10 1 0
1 11 1 0
2 12 1 0
5 13 1 0
6 14 1 0
7 15 1 0
8 16 1 0
9 17 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers