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
   -3.4923    1.4233   -2.3983 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2626    0.6585   -2.0272 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7200    1.1359   -0.8131 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5738    0.5755   -0.2710 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0442   -0.4589   -0.9227 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1754   -1.0025   -0.3756 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6883   -0.5243    0.8068 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0265    0.5307    1.4369 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0990    1.0880    0.9135 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8870   -1.0661    1.4309 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5792   -2.0474    0.9289 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3349    1.0559   -1.7758 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3525    2.5133   -2.3303 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7731    1.1848   -3.4533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4753    0.7627   -2.8123 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5222   -0.4096   -1.8654 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3074   -0.8798   -1.8533 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7008   -1.8322   -0.8655 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4041    0.9357    2.3754 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5791    1.9011    1.4320 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2063   -0.6126    2.3682 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3232   -2.5367    0.0151 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4571   -2.3952    1.4492 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