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
   -3.4433    0.5474    0.7759 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7658   -0.4789    0.1162 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3749   -0.4293   -0.0584 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7314   -1.4565   -0.7137 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6316   -1.4268   -0.8951 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3767   -0.3462   -0.4121 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7084    0.6564    0.2333 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6764    0.6448    0.4278 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7960   -0.2988   -0.5920 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5467    0.6691   -0.1713 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9214    0.7754    1.7345 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4963    1.4242    0.1011 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4881    0.1929    0.9983 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3491   -2.2914   -1.0808 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1030   -2.2480   -1.4127 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2091    1.5483    0.6487 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1706    1.4689    0.9503 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2797   -1.1326   -1.1183 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1397    1.5086    0.3471 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6264    0.6725   -0.3260 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