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
3.0651 0.2125 0.0933 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3419 -0.7854 -0.3523 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2266 -1.1640 0.3731 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0025 -0.5174 0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0791 -0.9434 0.9506 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3336 -0.3778 0.8553 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5042 0.6598 -0.0406 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4322 1.0879 -0.7969 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1821 0.5141 -0.6925 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7829 0.7078 0.9964 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9351 0.5265 -0.4499 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5983 -1.3243 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9250 -1.7650 1.6536 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1777 -0.7214 1.4567 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4562 1.1470 -0.1663 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5230 1.9087 -1.5205 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6658 0.8343 -1.2737 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