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
    3.5050    0.1010    0.1606 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3493    0.1048    0.7640 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2619   -0.6598    0.2962 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0522    0.0061    0.1516 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0848    1.3499    0.4497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3130    1.9499    0.2840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3871    1.1846   -0.1806 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2568   -0.1417   -0.4760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0262   -0.7466   -0.3110 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8244   -2.1871   -0.6164 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3122    0.6986    0.5482 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6487   -0.5016   -0.7263 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2235    0.7104    1.6457 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7895    1.9113    0.8126 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4603    2.9901    0.5042 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3484    1.6501   -0.3112 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0773   -0.7571   -0.8386 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0662   -2.5620   -0.0974 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7266   -2.3136   -1.7314 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7036   -2.7874   -0.3280 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