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
2.7043 0.8839 0.6413 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5174 -0.2425 -0.0186 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4215 -1.0290 0.1645 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1149 -0.6461 -0.0503 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9414 -1.5001 0.1576 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2546 -1.1224 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4529 0.1695 -0.4932 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4384 1.0756 -0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1392 0.6301 -0.4861 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9709 1.2328 1.3734 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5621 1.5146 0.5084 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2678 -0.5436 -0.7288 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8038 -2.5272 0.5038 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0845 -1.8147 0.1143 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4848 0.4920 -0.6694 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6140 2.0748 -1.0606 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6545 1.3524 -0.6688 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