Monomers

4-Methoxystyrene

Identifiers

IUPAC name
1-ethenyl-4-methoxybenzene
InchI
InChI=1S/C9H10O/c1-3-8-4-6-9(10-2)7-5-8/h3-7H,1H2,2H3
InchI Key
UAJRSHJHFRVGMG-UHFFFAOYSA-N
SMILES
COc1ccc(cc1)C=C
Canonical SMILES
COC1=CC=C(C=C1)C=C
Isomeric SMILES
COC1=CC=C(C=C1)C=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
2.3382
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
   -3.5793    0.3319   -0.1901 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6571   -0.6286   -0.6403 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2948   -0.4943   -0.4201 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8246    0.6005    0.2536 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5479    0.7202    0.4666 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4272   -0.2359    0.0143 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9172   -1.3485   -0.6737 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4337   -1.4686   -0.8847 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8684   -0.1431    0.2193 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4353    0.8445    0.8421 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5206    0.2100   -0.7849 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2358    1.3764   -0.3313 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7930    0.0985    0.8879 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4434    1.3973    0.6425 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9118    1.6084    1.0112 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6232   -2.0932   -1.0237 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8219   -2.3461   -1.4258 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5049   -0.9470   -0.1719 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8653    1.6510    1.2418 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5030    0.8665    0.9673 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  6  9  1  0
  9 10  2  3
  8  3  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  4 14  1  0
  5 15  1  0
  7 16  1  0
  8 17  1  0
  9 18  1  0
 10 19  1  0
 10 20  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers