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
    2.9034   -0.1659   -1.2341 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4205    0.7462   -0.4061 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0810    1.1059   -0.4005 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1613    0.2046    0.0648 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5314   -1.0475    0.5263 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4355   -1.9194    0.9850 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7703   -1.5518    0.9869 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1640   -0.3173    0.5351 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1857    0.5537    0.0755 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5569    1.9000   -0.4238 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9530   -0.4169   -1.2060 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2986   -0.6893   -1.9555 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0707    1.2415    0.2983 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5965   -1.3243    0.5182 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1297   -2.8898    1.3406 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5042   -2.2310    1.3421 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2043    0.0059    0.5218 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7379    2.6486   -0.2482 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8801    1.8838   -1.4836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4479    2.2630    0.1633 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