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
3.4981 0.5087 0.5443 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2613 0.7028 0.1136 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4372 -0.3781 -0.0042 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0511 -0.3200 -0.0347 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6242 0.8789 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0117 0.8675 0.0182 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7370 -0.2999 -0.1047 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0610 -1.5030 -0.1947 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6725 -1.4865 -0.1575 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8754 -0.4762 0.8052 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2035 1.3206 0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9696 1.7156 -0.1233 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0516 1.7931 0.1514 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5175 1.8141 0.0897 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8242 -0.2773 -0.1307 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6328 -2.4194 -0.2913 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1639 -2.4410 -0.2296 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