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
3.4523 -0.2755 0.0487 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2845 0.0285 0.5792 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3558 0.7902 -0.1241 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0144 0.4535 -0.1435 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9118 1.1986 -0.8348 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2577 0.8835 -0.8701 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6684 -0.2327 -0.1736 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7428 -0.9829 0.5211 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3911 -0.6627 0.5539 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1774 -0.8628 0.5818 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6661 0.0814 -0.9412 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0269 -0.3169 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5953 2.0883 -1.3921 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9559 1.5051 -1.4327 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7093 -0.5268 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0428 -1.8752 1.0832 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2978 -1.2935 1.1212 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