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
   -3.2562    0.8121   -0.2852 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1262   -0.4743    0.4809 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0690   -1.2486    0.0207 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7297   -0.8916    0.0016 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1954   -1.8106   -0.5071 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5215   -1.4386   -0.5177 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9726   -0.2177   -0.0558 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0150    0.6443    0.4329 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3306    0.3390    0.4745 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3820    0.1415   -0.0826 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8381    1.2810    0.3442 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2254    0.8510   -0.8668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4683    0.9312   -1.0672 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3224    1.6832    0.3964 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0563   -1.0837    0.3700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9297   -0.2584    1.5702 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1299   -2.7880   -0.8815 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2761   -2.1126   -0.9005 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2721    1.6313    0.8200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0698    1.0376    0.8683 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0773   -0.5973   -0.4855 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2472    2.0755    0.7577 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9160    1.4938    0.2975 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