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
    3.6885   -0.0753   -0.1173 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5836    0.3603   -0.8650 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2705    0.2029   -0.4747 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2635    0.6679   -1.2850 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0707    0.5260   -0.9226 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3745   -0.0886    0.2630 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3343   -0.5614    1.0856 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9834   -0.4194    0.7242 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7553   -0.2748    0.7124 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7673    0.1363    0.0043 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6140    0.1297   -0.6935 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8000    0.4797    0.8428 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6539   -1.1699    0.0900 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4516    1.1599   -2.2302 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8591    0.9069   -1.5889 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5777   -1.0447    2.0182 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8104   -0.7686    1.3277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9385   -0.7797    1.6820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6629    0.6271   -0.9332 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7792   -0.0141    0.3601 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