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
    3.6163    0.5800   -0.1077 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7447   -0.4260   -0.5184 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3662   -0.3704   -0.3375 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5747   -1.4075   -0.7728 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7896   -1.4294   -0.6325 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4498   -0.3499   -0.0147 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6516    0.6801    0.4163 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7316    0.6814    0.2635 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9009   -0.4041    0.1190 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5553    0.5646    0.6802 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9916    0.4296    0.9345 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5336    0.6229   -0.7430 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1531    1.5787   -0.1759 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0726   -2.2534   -1.2547 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3989   -2.2449   -0.9762 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1365    1.5353    0.9015 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2803    1.5319    0.6316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4598   -1.2643   -0.2529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0914    1.4461    1.0733 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6308    0.4993    0.7665 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