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
    3.6488   -0.0292    0.3825 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7376    0.1138   -0.6899 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3648    0.0713   -0.4507 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4389    0.2055   -1.4604 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9345    0.1559   -1.1703 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4003   -0.0246    0.1050 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4215   -0.1554    1.0929 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9118   -0.1128    0.8508 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8037   -0.0851    0.4721 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7495    0.0340   -0.4299 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4686    0.8251    1.0731 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6783   -0.0675    0.0126 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4341   -0.9581    0.9861 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7514    0.3501   -2.4854 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6446    0.2642   -1.9836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7673   -0.2999    2.1150 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6510   -0.2183    1.6451 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0575   -0.2340    1.5298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7839   -0.0140   -0.1347 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5225    0.1789   -1.4602 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