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
    3.4525   -0.9584    0.2209 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7742    0.2457    0.5210 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3858    0.3088    0.3380 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6942   -0.7893   -0.1282 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6872   -0.6534   -0.2860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3588    0.5126    0.0024 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6166    1.5696    0.4624 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7698    1.5017    0.6435 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7959    0.6293   -0.1699 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5729   -0.3307   -0.6028 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2418   -1.2965   -0.8264 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1368   -1.7659    0.8819 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5470   -0.7852    0.2966 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1981   -1.7271   -0.3655 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2301   -1.5119   -0.6508 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1374    2.4948    0.6930 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3014    2.3726    1.0107 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2418    1.6041    0.0883 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6415   -0.1241   -0.6912 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2195   -1.2968   -0.8716 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