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
   -3.3482   -0.1638    0.7105 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2002    0.3247   -0.7113 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0351    1.0921   -0.8477 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7656    0.6047   -0.6201 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4834   -0.6882   -0.2433 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7920   -1.1644   -0.0169 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8613   -0.3048   -0.1738 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6447    0.9955   -0.5480 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3400    1.4301   -0.7650 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2059   -0.8114    0.0662 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2852   -0.0971   -0.0499 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5329   -1.2450    0.7143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2170    0.3532    1.1971 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4539    0.1505    1.2972 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0916    0.9395   -0.9583 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1716   -0.5536   -1.4163 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3165   -1.3699   -0.1252 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9481   -2.2126    0.2834 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4787    1.7057   -0.6814 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1739    2.4597   -1.0609 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3299   -1.8605    0.3644 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2895    0.9379   -0.3346 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2668   -0.5224    0.1406 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