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
   -4.2896   -0.0224    0.1010 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8294    0.1552    0.3717 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0235   -0.3756   -0.6592 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6514   -0.2859   -0.5498 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0802    0.3073    0.5392 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2963    0.3982    0.6506 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1050   -0.1101   -0.3382 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5118   -0.7013   -1.4224 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1501   -0.7926   -1.5353 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5702   -0.0421   -0.2734 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2324    0.5021    0.7197 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6832    0.9510   -0.2886 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7975   -0.2894    1.0630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4359   -0.7935   -0.6819 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5765    1.2372    0.4885 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5184   -0.3109    1.3487 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6721    0.7227    1.3443 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7102    0.8691    1.5167 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1439   -1.1176   -2.2309 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3168   -1.2736   -2.4181 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1340   -0.4770   -1.1140 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3022    0.5164    0.7005 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7182    0.9327    1.5500 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