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
   -3.6811   -0.1803   -0.3288 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5387   -0.9795   -0.2910 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2411   -0.5493   -0.2375 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2315   -1.4863   -0.2057 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0916   -1.0412   -0.1511 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3519    0.3070   -0.1306 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3100    1.2422   -0.1637 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9746    0.8009   -0.2168 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7004    0.8321   -0.0745 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7683    0.0780   -0.0390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5736   -0.6853    0.1317 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5921    0.7861    0.1860 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9618   -0.0540   -1.4096 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4222   -2.5571   -0.2213 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8727   -1.7873   -0.1267 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5408    2.3126   -0.1465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7576    1.5639   -0.2412 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8824    1.9112   -0.0591 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6796   -0.9840   -0.0507 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7767    0.4702    0.0029 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