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
    3.6476   -0.0664   -0.4396 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7451    0.4537    0.4983 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3639    0.2763    0.3712 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8661   -0.4369   -0.7169 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4937   -0.6155   -0.8485 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3892   -0.1073    0.0697 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8859    0.5862    1.1254 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4790    0.7880    1.2936 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8265   -0.3363   -0.1339 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7444    0.1045    0.6787 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3223    0.1750   -1.4614 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6606    0.3663   -0.2083 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6905   -1.1842   -0.2964 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5586   -0.8523   -1.4628 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8543   -1.1758   -1.7068 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5549    1.0005    1.8670 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8806    1.3382    2.1311 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1454   -0.9043   -1.0095 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5289    0.6750    1.5699 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7912   -0.0847    0.4945 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