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
   -4.2188    0.9619    0.0750 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7310    1.0998   -0.1873 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0785   -0.0993    0.1845 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7212   -0.1729    0.0223 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0043    0.8750   -0.4846 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3776    0.7947   -0.6466 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0693   -0.3545   -0.2995 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3135   -1.3743    0.2008 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0597   -1.3189    0.3723 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5088   -0.4208   -0.4761 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2271   -1.4727   -0.1704 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7473    1.6239   -0.6251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4523    1.1467    1.1350 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5436   -0.0717   -0.1512 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5394    1.3070   -1.2653 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2711    1.9218    0.3765 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4798    1.8199   -0.7818 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9611    1.6212   -1.0480 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8357   -2.2972    0.4841 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5963   -2.1883    0.7837 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0303    0.4431   -0.8832 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8251   -2.3849    0.2386 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2861   -1.4595   -0.3243 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