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
   -4.2899    0.3127    0.1585 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8158    0.3275    0.4130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0789   -0.1141   -0.6928 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6776   -0.1457   -0.5761 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0387    0.2378    0.5696 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3422    0.1876    0.6322 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1142   -0.2342   -0.4143 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4295   -0.6206   -1.5746 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0575   -0.5795   -1.6609 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5594   -0.3078   -0.4066 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2643    0.0402    0.6519 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4562   -0.1373   -0.8411 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6570    1.3603    0.2089 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8041   -0.2496    0.9599 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5643   -0.3599    1.2645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4416    1.3552    0.6595 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6090    0.5729    1.4072 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8242    0.4965    1.5505 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0212   -0.9523   -2.3997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4109   -0.8940   -2.5925 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0949   -0.6626   -1.3037 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7704    0.3871    1.5336 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3662   -0.0199    0.6467 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