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
   -4.3328    0.0671    0.1446 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9183    0.4335   -0.2731 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0413   -0.3167    0.4984 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6696   -0.2799    0.4291 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0759   -1.0858    1.2623 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4509   -1.0869    1.2329 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1734   -0.2677    0.3531 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4335    0.5364   -0.4782 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0411    0.5231   -0.4332 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6137   -0.2727    0.3263 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3269    0.4767   -0.4795 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5851    0.7419    0.9973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0483    0.1768   -0.6948 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3975   -0.9766    0.5271 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7848    1.5414   -0.1035 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7933    0.2963   -1.3665 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4441   -1.7479    1.9719 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0323   -1.7266    1.8944 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9232    1.1997   -1.1884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5037    1.1686   -1.1016 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1175   -0.9530    1.0322 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4246    0.3794   -0.4014 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9057    1.1727   -1.2040 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