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
    3.4398   -0.3548    0.2073 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3311   -0.2699    0.9048 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1199   -0.7856    0.4995 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0333   -0.0156    0.1613 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1638    1.3580    0.2320 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9149    2.1506   -0.1031 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1107    1.5616   -0.5048 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1997    0.1802   -0.5622 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1329   -0.6403   -0.2315 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2485   -2.1303   -0.2998 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3877    0.0475    0.5219 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4203   -0.8572   -0.7474 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4078    0.2527    1.8704 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1012    1.8379    0.5473 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8048    3.2248   -0.0452 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9391    2.2129   -0.7614 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1355   -0.2616   -0.8762 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7352   -2.6050    0.5791 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3304   -2.3611   -0.1568 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8532   -2.5446   -1.2353 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