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
   -3.3655    0.3925    0.8676 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2037   -0.4085   -0.3996 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0247   -1.1388   -0.4016 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7351   -0.6854   -0.3351 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4929    0.6602   -0.2630 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8173    1.1254   -0.1940 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9112    0.2685   -0.1953 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6317   -1.0705   -0.2687 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3221   -1.5663   -0.3390 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2524    0.8199   -0.1210 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3423    0.0943   -0.1164 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4717    0.2726    1.4879 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5096    1.4612    0.6098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2606    0.0137    1.4466 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0673   -1.1188   -0.4746 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3106    0.2530   -1.3007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3026    1.3690   -0.2644 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0096    2.1845   -0.1369 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4294   -1.7878   -0.2741 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1179   -2.6287   -0.3966 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3638    1.9037   -0.0656 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2968    0.5633   -0.0600 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2499   -0.9772   -0.1706 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