Monomers

1-Methyl-4-(vinyloxy)benzene

Identifiers

IUPAC name
1-ethenoxy-4-methylbenzene
InchI
InChI=1S/C9H10O/c1-3-10-9-6-4-8(2)5-7-9/h3-7H,1H2,2H3
InchI Key
YXHRYLHTQVXZIK-UHFFFAOYSA-N
SMILES
C=COc1ccc(cc1)C
Canonical SMILES
CC1=CC=C(C=C1)OC=C
Isomeric SMILES
CC1=CC=C(C=C1)OC=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
    3.5032   -0.5151   -0.2039 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0676    0.7273   -0.3678 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0073    0.9930   -1.2127 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7244    0.6078   -0.8466 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3709    0.8476   -1.6514 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6423    0.4597   -1.2766 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8447   -0.1818   -0.0780 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7461   -0.4184    0.7216 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5064   -0.0370    0.3536 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2238   -0.6112    0.3457 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0213   -1.3222   -0.7378 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3254   -0.7346    0.4490 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5355    1.5463    0.1563 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2086    1.3594   -2.6077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4889    0.6670   -1.9418 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9649   -0.9346    1.6691 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3346   -0.2535    1.0313 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8228    0.2866    0.5131 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6010   -1.2396   -0.5048 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1117   -1.2468    1.2456 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
  7 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
  8 16  1  0
  9 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