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
   -3.4447    1.1068   -0.3335 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6579    0.5919    0.7161 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3164    0.2967    0.5678 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7407    0.5183   -0.6538 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6138    0.2150   -0.7865 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3798   -0.2883    0.2419 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7070   -0.4837    1.4581 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6178   -0.2041    1.6443 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7909   -0.6133    0.1341 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4598   -0.4520   -0.9655 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5556    0.3157   -1.1329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9305    2.0001   -0.7932 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4307    1.3724    0.0892 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3206    0.9127   -1.4768 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0638    0.3910   -1.7506 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3023   -0.8843    2.2889 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1050   -0.3699    2.6060 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2970   -1.0021    1.0005 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9994   -0.0694   -1.8501 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5060   -0.7055   -1.0039 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