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
3.1316 0.1621 -0.3077 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3248 -0.1184 0.7019 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2804 -1.0068 0.4701 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0183 -0.5402 0.2065 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0144 -1.4185 -0.0229 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2889 -0.9636 -0.2893 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5305 0.3946 -0.3261 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5070 1.2848 -0.0986 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2297 0.8178 0.1683 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9361 0.8476 -0.1257 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0150 -0.2579 -1.2735 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4444 0.3068 1.6761 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8627 -2.5051 -0.0023 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1222 -1.6527 -0.4741 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5228 0.7454 -0.5335 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6424 2.3596 -0.1158 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5702 1.5446 0.3465 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