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
    3.6546   -0.1538   -0.3947 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5372   -0.9601   -0.5993 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2359   -0.6148   -0.3461 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8514    0.6059    0.1567 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5077    0.8541    0.3781 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4981   -0.0566    0.1218 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0879   -1.2896   -0.3881 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2422   -1.5422   -0.6085 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9143    0.1652    0.3385 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3563    1.2873    0.8092 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1159   -0.3470    0.5831 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4418    0.9434   -0.5152 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4421   -0.3682   -1.1679 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6222    1.3290    0.3617 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500    1.8177    0.7694 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8453   -2.0435   -0.6061 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5203   -2.5054   -1.0029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6092   -0.6220    0.1018 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6833    2.0774    1.0490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4116    1.4231    0.9594 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