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
   -3.5978    0.4598    0.1637 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3045    0.9536    0.0237 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1431    0.2076    0.1122 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0866   -1.1312    0.3509 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1149   -1.8033    0.4244 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2966   -1.0788    0.2473 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2702    0.2633    0.0068 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0500    0.8915   -0.0581 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5045    1.0456   -0.1828 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6902    0.5158   -0.1343 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9510    0.4671    1.2220 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2830    1.1880   -0.3631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7828   -0.5146   -0.3064 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0335   -1.6718    0.4856 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1629   -2.8609    0.6129 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2031   -1.6322    0.3111 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0467    1.9766   -0.2533 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4128    2.1143   -0.3715 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8710   -0.5266    0.0461 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5596    1.1363   -0.2803 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