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
2.8868 -0.4277 0.2495 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3820 0.7421 0.5901 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1544 0.8036 1.1787 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0313 0.3943 0.5947 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2203 0.5028 1.2852 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4154 0.0853 0.6842 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4148 -0.4323 -0.5888 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2392 -0.5500 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0600 -0.1261 -0.6748 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8724 -0.4963 -0.2247 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3229 -1.3264 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9754 1.6512 0.3865 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2085 0.9126 2.2886 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3541 0.1640 1.2121 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3426 -0.7474 -1.0331 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2083 -0.9522 -2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9005 -0.1974 -1.1923 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