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
    3.8069    0.1383   -0.6474 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0579   -0.3240    0.3348 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9908   -1.1964    0.0720 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7043   -0.6867   -0.0476 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3254   -1.5670   -0.3059 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6386   -1.1470   -0.4407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9251    0.1963   -0.3120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8923    1.0976   -0.0506 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4164    0.6591    0.0812 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3060    0.6930   -0.4468 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6176    0.8034   -0.4305 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6263   -0.1348   -1.6671 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2852   -0.0155    1.3439 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0899   -2.6181   -0.4049 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4568   -1.8440   -0.6457 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1132    2.1321    0.0485 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2258    1.3547    0.2848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9979   -0.1495   -0.1940 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5122    1.0500   -1.4736 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4737    1.5583    0.2273 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