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
    4.3102   -0.4103   -0.0979 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9187    0.2161   -0.2116 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9692   -0.7131    0.2965 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6249   -0.3525    0.2922 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1856    0.8626   -0.1830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1455    1.2010   -0.1792 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0911    0.2961    0.3181 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6268   -0.9081    0.7857 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2762   -1.2683    0.7891 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4918    0.6702    0.3143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4183   -0.1403    0.7686 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5815   -0.4792    0.9657 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9897    0.2747   -0.6396 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2638   -1.4149   -0.5307 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8551    1.1464    0.3907 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6491    0.4122   -1.2548 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9542    1.5351   -0.5599 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4679    2.1750   -0.5634 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3393   -1.6313    1.1782 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0081   -2.2382    1.1759 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7446    1.6580   -0.0837 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4596    0.2298    0.7261 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2490   -1.1211    1.1731 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