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
   -3.2404    1.0885   -0.5024 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1571   -0.3919   -0.7412 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1857   -1.0400    0.0320 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8294   -0.7505   -0.0097 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2752    0.2152   -0.8225 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1027    0.4394   -0.7991 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9607   -0.2692    0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3802   -1.2334    0.8191 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0162   -1.4733    0.8127 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3941   -0.0637    0.0625 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0129    0.8397   -0.6808 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2476    1.3839   -0.0854 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4711    1.3742    0.2599 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1414    1.6915   -1.4336 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1459   -0.8376   -0.4527 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9458   -0.6398   -1.8065 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9179    0.7918   -1.4734 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5154    1.1897   -1.4337 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0036   -1.8331    1.4881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4028   -2.2393    1.4610 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9719   -0.6772    0.7367 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5140    1.4904   -1.3765 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0886    0.9446   -0.5967 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