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
    3.6524   -0.2295    0.0403 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7052    0.8169   -0.1391 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3503    0.4926   -0.0842 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3764    1.4445   -0.2473 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9866    1.1289   -0.1939 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3654   -0.1574    0.0259 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4009   -1.1279    0.1923 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9280   -0.8018    0.1370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7498   -0.5960    0.1002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7263    0.2649   -0.0474 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6780    0.1453   -0.0285 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4332   -0.9778   -0.7603 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4196   -0.6614    1.0573 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6291    2.4880   -0.4257 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7115    1.9328   -0.3317 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6677   -2.1803    0.3721 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6984   -1.5496    0.2652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9802   -1.6651    0.2829 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5295    1.2911   -0.2227 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7526   -0.0582    0.0074 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