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
    3.3461   -0.2063    0.2484 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3148   -0.1455   -0.5836 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3539    0.8055   -0.5323 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0258    0.6945   -0.2552 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7768    1.8634   -0.2661 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1153    1.8450   -0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7789    0.6764    0.2985 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0283   -0.4656    0.3157 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6500   -0.4591    0.0440 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0930   -1.7511    0.0834 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0604   -0.9886    0.1407 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4110    0.5517    1.0048 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2915   -0.9467   -1.3469 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2360    2.7787   -0.5044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6913    2.7867   -0.0231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8426    0.7038    0.5035 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4775   -1.4169    0.5407 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6075   -2.5303    0.5303 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9779   -1.6811    0.7329 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3296   -2.1145   -0.9308 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