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
    3.5390    0.7785   -0.3740 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7766   -0.3609   -0.1114 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4063   -0.4010   -0.0616 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6818    0.7505   -0.2820 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7074    0.6949   -0.2283 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4111   -0.4543    0.0349 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6357   -1.6022    0.2530 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7373   -1.5710    0.2049 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8612   -0.5266    0.0940 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5992    0.5321   -0.1065 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1250    1.7137    0.0564 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5848    0.6976    0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6136    0.9291   -1.4692 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1648    1.7063   -0.4979 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2437    1.6188   -0.4065 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1819   -2.5268    0.4641 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2781   -2.5044    0.3850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3183   -1.4761    0.3076 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7035    0.4732   -0.0607 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2453    1.5285   -0.3269 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