Monomers

1-Ethenoxy-2-methylbenzene

Identifiers

IUPAC name
1-ethenoxy-2-methylbenzene
InchI
InChI=1S/C9H10O/c1-3-10-9-7-5-4-6-8(9)2/h3-7H,1H2,2H3
InchI Key
TWWWGBSUPNNTMJ-UHFFFAOYSA-N
SMILES
C=COc1ccccc1C
Canonical SMILES
CC1=CC=CC=C1OC=C
Isomeric SMILES
CC1=CC=CC=C1OC=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
2.5173
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
    3.5846   -0.5834    0.1177 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3566   -0.8433   -0.2973 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3696    0.0621   -0.0190 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0249   -0.1504   -0.0923 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4993   -1.3682   -0.4758 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8883   -1.5310   -0.5338 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7488   -0.4983   -0.2152 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2156    0.7190    0.1682 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8359    0.8773    0.2247 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2618    2.1772    0.6341 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4201   -1.2570   -0.0668 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8378    0.3201    0.6699 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1995   -1.7631   -0.8370 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1235   -2.2081   -0.7353 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2890   -2.4737   -0.8306 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8022   -0.6365   -0.2637 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8988    1.5231    0.4162 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7713    2.3211    0.3038 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3797    2.3474    1.7327 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8687    2.9655    0.0996 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
  9  4  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  5 14  1  0
  6 15  1  0
  7 16  1  0
  8 17  1  0
 10 18  1  0
 10 19  1  0
 10 20  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers