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
    3.4985   -0.3284    0.0623 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3553   -0.6489   -0.5075 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3187    0.2687   -0.5652 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0418   -0.0751   -0.1324 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1780   -1.3365    0.3530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4423   -1.6718    0.7797 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5061   -0.7935    0.7423 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2453    0.4679    0.2468 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9921    0.8415   -0.1904 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7192    2.2073   -0.7245 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6267    0.6548    0.4862 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3135   -1.0269    0.1164 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2661   -1.6442   -0.9207 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6463   -2.0647    0.3983 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6045   -2.6703    1.1610 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5032   -1.0603    1.0796 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0655    1.1953    0.2007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3019    2.9838   -0.2196 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3797    2.4187   -0.5630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8887    2.2827   -1.8030 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