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
   -3.2574    0.7957    0.3503 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0840   -0.5454   -0.3204 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0468   -1.3088    0.1992 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7281   -0.9387    0.1853 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3621    0.2509   -0.3820 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9799    0.6270   -0.3937 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9527   -0.1729    0.1538 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5868   -1.3920    0.7359 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2684   -1.7198    0.7261 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3557    0.2078    0.1481 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7728    1.3324   -0.3781 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2343    0.7966    0.9138 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2851    1.6474   -0.3668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4390    0.9448    1.0870 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0257   -1.1481   -0.2190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9856   -0.3773   -1.4239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0826    0.9423   -0.8494 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2120    1.5853   -0.8589 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3611   -2.0340    1.1743 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0195   -2.6710    1.1799 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0659   -0.4683    0.5956 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8466    1.5771   -0.3583 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1482    2.0692   -0.8455 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