Monomers

1-Methoxy-3-vinylbenzene

Identifiers

IUPAC name
1-ethenyl-3-methoxybenzene
InchI
InChI=1S/C9H10O/c1-3-8-5-4-6-9(7-8)10-2/h3-7H,1H2,2H3
InchI Key
PECUPOXPPBBFLU-UHFFFAOYSA-N
SMILES
COc1cccc(c1)C=C
Canonical SMILES
COC1=CC=CC(=C1)C=C
Isomeric SMILES
COC1=CC=CC(=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
    2.4409   -1.5701    0.5465 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4543   -0.2662    0.0284 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2656    0.3805   -0.1885 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2971    1.6755   -0.7035 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1207    2.3511   -0.9323 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0479    1.6972   -0.6336 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0926    0.3933   -0.1146 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0836   -0.2721    0.1102 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3835   -0.2141    0.1698 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5492   -1.4179    0.6529 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1130   -1.5907    1.6064 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8203   -2.1905   -0.1213 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4898   -1.9619    0.4621 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2428    2.1436   -0.9210 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1540    3.3584   -1.3332 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9727    2.2119   -0.8070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1015   -1.2946    0.5154 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2970    0.3741   -0.0329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5594   -1.7866    0.8331 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6816   -2.0209    0.8631 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
  7  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
  6 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