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
   -3.0454    1.4625    0.2814 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8584    0.9079   -1.0941 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1202   -0.2784   -1.0460 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8353   -0.4151   -0.5705 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0762    0.6172   -0.0698 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2207    0.4540    0.4061 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7602   -0.8049    0.3692 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0188   -1.8887   -0.1350 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2546   -1.6761   -0.5919 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0978   -1.1044    0.8341 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8684   -0.1850    1.3173 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1155    1.4673    0.5890 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4997    0.8453    1.0196 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6708    2.5127    0.3929 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8621    0.6583   -1.5010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3970    1.6576   -1.7772 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5094    1.6090   -0.0483 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7795    1.2890    0.7897 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4531   -2.8923   -0.1629 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8396   -2.5134   -0.9861 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4593   -2.1168    0.7760 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5663    0.8319    1.3996 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8603   -0.4377    1.6560 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