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
    3.2982   -0.4288   -0.2610 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3940   -0.7066    0.6578 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0830   -0.9679    0.3811 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0924   -0.0354    0.1895 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3385    1.3262    0.2617 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7073    2.1973    0.0577 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9679    1.7563   -0.2113 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1992    0.3965   -0.2804 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1876   -0.5224   -0.0842 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4528   -1.9933   -0.1621 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0444   -0.3902   -1.3283 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3268   -0.2251   -0.0298 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7221   -0.7257    1.6871 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3515    1.6730    0.4777 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5301    3.2617    0.1110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7789    2.4442   -0.3694 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2083    0.0268   -0.4960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6799   -2.5585    0.3973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4098   -2.1750    0.3811 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5290   -2.3529   -1.1883 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