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
3.0858 -0.6206 0.3721 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3309 -0.3971 -0.6811 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4245 0.6437 -0.6955 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1045 0.4554 -0.3378 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7765 1.5112 -0.3616 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0977 1.3337 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5862 0.1043 0.3841 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6948 -0.9461 0.4042 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3738 -0.7634 0.0475 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8022 -1.4236 0.4152 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9816 0.0292 1.2283 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4425 -1.0507 -1.5298 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4542 2.5030 -0.6592 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7845 2.1832 -0.0305 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6429 -0.0272 0.6662 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0548 -1.9213 0.7071 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2934 -1.6137 0.0768 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