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
   -3.6171    0.0599    0.7131 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7395   -0.4731   -0.2680 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3697   -0.2703   -0.1876 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5435   -0.7982   -1.1519 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8332   -0.6017   -1.0824 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4069    0.1167   -0.0620 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5468    0.6405    0.9018 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8223    0.4536    0.8461 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8359    0.3465    0.0505 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7118   -0.1071   -0.8067 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7030    1.1503    0.5400 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2090   -0.1596    1.7389 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6253   -0.3909    0.6090 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0048   -1.3615   -1.9500 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4412   -1.0242   -1.8450 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9673    1.2024    1.7048 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4533    0.8688    1.6011 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1895    0.9332    0.9036 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7542    0.0970   -0.6680 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4007   -0.6825   -1.6495 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