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
   -3.2709   -0.5783   -0.5779 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3160   -0.3828    0.3444 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1625   -1.0831    0.3613 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1373   -0.6684    0.1806 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1491   -1.6362    0.2539 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4834   -1.3565    0.0927 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8423   -0.0567   -0.1537 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8955    0.9378   -0.2371 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5399    0.6268   -0.0688 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4658    1.7076   -0.1607 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0640   -1.3360   -1.3154 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1917   -0.0351   -0.6100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5458    0.3850    1.0782 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8224   -2.6581    0.4514 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2143   -2.1761    0.1656 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8868    0.1979   -0.2858 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1517    1.9761   -0.4311 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3068    1.5063   -0.8248 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0543    2.6040   -0.6062 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8535    2.0257    0.8419 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