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
2.8681 -0.0952 0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3203 -0.8597 -0.1821 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0648 -1.4007 -0.0178 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0817 -0.6053 0.0826 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3009 -1.2282 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4266 -0.4604 0.3451 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3508 0.9143 0.2834 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1493 1.5304 0.1222 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0118 0.7617 0.0192 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8489 0.3361 0.6269 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3015 0.0985 1.6357 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8887 -1.0512 -1.0763 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3243 -2.3287 0.2911 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3763 -0.9676 0.4732 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2527 1.4922 0.3641 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0245 2.6172 0.0661 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9829 1.2466 -0.1105 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