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
   -4.2981    0.2580    0.1488 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9267   -0.3247   -0.0401 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9437    0.6749    0.0917 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5961    0.3466   -0.0478 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2009   -0.9490   -0.3148 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1423   -1.2269   -0.4446 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1041   -0.2179   -0.3098 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6894    1.0675   -0.0436 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3270    1.3629    0.0906 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5033   -0.5739   -0.4575 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4442    0.3251   -0.3422 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0480   -0.5030   -0.1882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4805    0.4632    1.2151 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4466    1.2054   -0.3975 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8971   -0.8469   -1.0099 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7680   -1.0742    0.7744 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9153   -1.7495   -0.4246 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4332   -2.2585   -0.6558 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3741    1.8963    0.0732 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0196    2.3651    0.2995 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7732   -1.6079   -0.6681 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4794    0.0047   -0.4623 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2703    1.3626   -0.1366 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