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
2.9638 0.3333 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3152 -0.6967 -0.4171 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2496 -1.2246 0.3105 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0050 -0.6199 0.2093 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1694 0.4833 -0.5982 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3779 1.1312 -0.7438 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4491 0.6150 -0.0237 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2794 -0.4870 0.7842 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0682 -1.1295 0.9248 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6914 0.7786 1.0411 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7887 0.7770 -0.4337 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6302 -1.0893 -1.3622 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6704 0.8813 -1.1576 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5011 1.9986 -1.3828 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4037 1.1231 -0.1359 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1262 -0.8782 1.3403 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9394 -1.9963 1.5616 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