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
   -4.3353   -0.2548    0.0228 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9633   -0.0328   -0.6288 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0092   -0.1898    0.3728 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6445   -0.0735    0.2129 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0423    0.2196   -0.9870 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3284    0.3242   -1.0906 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1409    0.1329    0.0318 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5289   -0.1589    1.2233 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1549   -0.2607    1.3127 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5801    0.2475   -0.0992 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4055    0.0818    0.9069 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2086   -0.9198    0.8898 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6914    0.7170    0.4071 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0375   -0.7396   -0.6758 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8851   -0.7381   -1.4642 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9183    1.0282   -1.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6622    0.3749   -1.8871 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8216    0.5559   -2.0348 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1112   -0.3208    2.1436 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2821   -0.4980    2.2988 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0266    0.4823   -1.0709 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4874    0.1741    0.7798 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0944   -0.1515    1.9097 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