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
   -3.0376   -0.4078   -0.6719 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5405    0.3600    0.2773 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3202    0.9556    0.0634 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1849    0.1480    0.0262 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2744   -1.2212    0.1994 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8807   -1.9775    0.1538 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0979   -1.3741   -0.0606 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1530   -0.0073   -0.2294 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0220    0.7787   -0.1902 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1876    2.2326   -0.3823 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5350   -0.5923   -1.6081 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9948   -0.8744   -0.5031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0584    0.5285    1.1992 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2203   -1.7085    0.3682 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8708   -3.0556    0.2831 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0075   -1.9930   -0.0937 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1516    0.4141   -0.3966 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8304    2.3904   -1.2750 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7577    2.6463    0.4829 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2071    2.7577   -0.4947 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