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
3.3673 -0.0619 0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2516 0.6078 0.3569 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4401 0.3377 -0.7356 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0902 0.1184 -0.4893 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4534 0.1600 0.7754 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8024 -0.0615 1.0013 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6551 -0.3346 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1234 -0.3790 -1.3214 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7784 -0.1568 -1.5337 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9910 0.1556 1.4468 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6293 -0.8411 -0.1042 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9322 1.4059 1.0249 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2177 0.3736 1.5918 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2350 -0.0298 1.9956 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7177 -0.5077 0.1395 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7897 -0.5923 -2.1425 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3644 -0.1944 -2.5506 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