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
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
-3.5141 0.3944 -0.5801 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2809 0.5608 -0.1037 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4110 -0.4866 -0.0976 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0437 -0.3952 -0.2723 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7789 -1.4956 -0.2549 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1564 -1.3992 -0.4313 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7080 -0.1388 -0.6316 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9084 0.9832 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5289 0.8363 -0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8335 -0.5584 -0.9612 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1892 1.2502 -0.5727 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9616 1.5196 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3363 -2.4696 -0.0982 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8012 -2.2764 -0.4162 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7820 -0.0312 -0.7726 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3172 1.9784 -0.8089 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0831 1.7280 -0.4927 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