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
3.1637 -0.1909 0.3368 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2969 -0.4605 -0.6156 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1690 -1.1905 -0.3060 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0530 -0.5837 -0.1315 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1522 0.8005 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3555 1.4582 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4965 0.7466 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3823 -0.6234 0.3388 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1827 -1.2879 0.1754 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0728 0.3847 0.1398 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0413 -0.5125 1.3609 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4694 -0.1157 -1.6158 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7298 1.3798 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4708 2.5299 -0.2063 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4670 1.2349 0.3419 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2596 -1.2079 0.5815 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1230 -2.3617 0.2871 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