Monomers

4-Methoxystyrene

Identifiers

IUPAC name
1-ethenyl-4-methoxybenzene
InchI
InChI=1S/C9H10O/c1-3-8-4-6-9(10-2)7-5-8/h3-7H,1H2,2H3
InchI Key
UAJRSHJHFRVGMG-UHFFFAOYSA-N
SMILES
COc1ccc(cc1)C=C
Canonical SMILES
COC1=CC=C(C=C1)C=C
Isomeric SMILES
COC1=CC=C(C=C1)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C9H10O
Heavy Atom Count
10
Molecular Weight
134.178
Exact Molecular Weight
134.0732
Valence Electrons
52
Radical Electrons
0
tPSA
9.23
MolLogP
2.3382
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

 20 20  0  0  0  0  0  0  0  0999 V2000
    3.6232    0.0976    0.8122 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7140   -0.5462   -0.0565 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3562   -0.2875   -0.0633 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5671   -0.9770   -0.9554 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7944   -0.7491   -0.9956 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4109    0.1549   -0.1672 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6105    0.8465    0.7295 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7481    0.6227    0.7735 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8329    0.4030   -0.1985 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6591   -0.2005   -1.0074 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6251   -0.3413    0.6026 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7033    1.1816    0.6205 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4076   -0.1289    1.8903 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9814   -1.7119   -1.6469 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3884   -1.3231   -1.7254 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0302    1.5726    1.4106 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3781    1.1685    1.4807 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2697    1.1419    0.4927 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7366    0.0203   -0.9964 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3712   -0.9440   -1.7343 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  6  9  1  0
  9 10  2  3
  8  3  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  4 14  1  0
  5 15  1  0
  7 16  1  0
  8 17  1  0
  9 18  1  0
 10 19  1  0
 10 20  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers