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
   -4.2811    0.3638    0.1542 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7974    0.6264   -0.0116 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0594   -0.5415    0.2362 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6968   -0.5185    0.1394 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0506    0.6412   -0.1987 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3356    0.6753   -0.2999 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1195   -0.4277   -0.0716 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4233   -1.5962    0.2720 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0610   -1.6324    0.3722 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5689   -0.4591   -0.1604 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2665    0.5972   -0.4756 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6856   -0.1365   -0.7322 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3792   -0.2506    1.0847 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7554    1.3525    0.3574 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5149    1.4674    0.6387 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6019    0.9525   -1.0546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6010    1.5732   -0.3990 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8301    1.6228   -0.5739 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0271   -2.4902    0.4592 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4310   -2.5700    0.6435 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0834   -1.3677    0.0364 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3602    0.5832   -0.5451 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7783    1.5349   -0.6816 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