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
    3.5657   -0.1146   -0.1647 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5849   -1.0942    0.0636 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2477   -0.7442   -0.0098 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2925   -1.7070    0.2145 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0292   -1.3676    0.1435 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4465   -0.0786   -0.1487 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4576    0.8426   -0.3637 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8798    0.5338   -0.2996 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8654    0.2384   -0.2142 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3269    1.4284   -0.4834 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3880    0.8017    0.4692 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5846    0.2417   -1.2013 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5518   -0.5052    0.1188 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5827   -2.7484    0.4508 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7770   -2.1464    0.3248 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7488    1.8646   -0.5954 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6077    1.3368   -0.4864 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5685   -0.6011   -0.0193 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6763    2.2443   -0.6726 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3891    1.5752   -0.5118 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