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
    3.6564   -0.5398   -0.4694 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5029   -0.0886   -1.0948 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2424   -0.0347   -0.5601 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2214    0.4466   -1.3406 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0862    0.5255   -0.8494 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3752    0.1260    0.4156 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3465   -0.3615    1.2093 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9417   -0.4378    0.7214 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7055    0.1863    0.9708 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7081    0.6366    0.2649 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2573   -1.0970   -1.2469 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3221    0.2375   -0.0829 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4632   -1.2712    0.3279 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3924    0.7860   -2.3750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8460    0.9237   -1.5413 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5099   -0.6979    2.2310 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7326   -0.8269    1.3711 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8759   -0.1538    2.0077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5891    0.9721   -0.7316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6900    0.6689    0.7087 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