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
   -4.2819   -0.2030    0.1233 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8066   -0.4295    0.1161 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0562    0.7136   -0.1456 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6608    0.6018   -0.1735 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1213    1.7272   -0.4328 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4897    1.5780   -0.4519 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1034    0.3504   -0.2224 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3131   -0.7471    0.0314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0509   -0.6098    0.0529 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5488    0.2264   -0.2496 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2227   -0.8852   -0.0460 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6938   -0.4627   -0.8886 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7342   -0.9540    0.8256 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5839    0.8245    0.3907 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4576   -0.8392    1.1022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5947   -1.2474   -0.6280 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3522    2.6881   -0.6126 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1215    2.4409   -0.6519 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7904   -1.7271    0.2151 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6307   -1.5112    0.2588 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1083    1.1575   -0.4610 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2994   -0.8508   -0.0922 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7848   -1.8415    0.1662 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