Monomers

4-Ethoxystyrene

Identifiers

IUPAC name
1-ethenyl-4-ethoxybenzene
InchI
InChI=1S/C10H12O/c1-3-9-5-7-10(8-6-9)11-4-2/h3,5-8H,1,4H2,2H3
InchI Key
OBRYRJYZWVLVLF-UHFFFAOYSA-N
SMILES
CCOc1ccc(cc1)C=C
Canonical SMILES
CCOC1=CC=C(C=C1)C=C
Isomeric SMILES
CCOC1=CC=C(C=C1)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H12O
Heavy Atom Count
11
Molecular Weight
148.205
Exact Molecular Weight
148.0888
Valence Electrons
58
Radical Electrons
0
tPSA
9.23
MolLogP
2.7283
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

 23 23  0  0  0  0  0  0  0  0999 V2000
    3.1347    1.0286   -0.8998 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1803    0.1255    0.2906 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2436   -0.9272    0.2642 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8699   -0.7682    0.2228 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2981    0.4801    0.2102 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0864    0.6099    0.1675 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9497   -0.4550    0.1361 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3377   -1.7212    0.1500 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0227   -1.8732    0.1919 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3975   -0.3499    0.0913 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9974    0.8049    0.0772 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0903    0.8964   -1.4785 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3135    0.7531   -1.5868 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0509    2.0790   -0.5752 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2126   -0.2737    0.4400 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9388    0.7157    1.2196 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9198    1.3888    0.2376 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4893    1.6130    0.1590 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9824   -2.5759    0.1265 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4751   -2.8655    0.2019 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9686   -1.2584    0.0698 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4562    1.7532    0.0979 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0852    0.8200    0.0432 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  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
  7 10  1  0
 10 11  2  3
  9  4  1  0
  1 12  1  0
  1 13  1  0
  1 14  1  0
  2 15  1  0
  2 16  1  0
  5 17  1  0
  6 18  1  0
  8 19  1  0
  9 20  1  0
 10 21  1  0
 11 22  1  0
 11 23  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers