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
    3.6417    0.7006   -0.1353 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4410    1.1842    0.3800 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1959    0.6394    0.0992 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0757   -0.4497   -0.7354 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1543   -0.9992   -1.0216 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3167   -0.4603   -0.4677 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2043    0.6221    0.3626 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0551    1.1770    0.6496 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5803   -1.0712   -0.7980 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7128   -0.6188   -0.3149 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8941   -0.3092    0.2467 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4951    0.5716   -1.2455 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4424    1.4403    0.0651 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0001   -0.8449   -1.1500 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2284   -1.8619   -1.6852 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0806    1.0508    0.7976 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1027    2.0386    1.3154 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5944   -1.9325   -1.4674 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6746   -1.0934   -0.5737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7974    0.2164    0.3456 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