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
    3.6269   -0.0990    0.5028 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7049    0.5628   -0.3445 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3478    0.3252   -0.2031 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8897   -0.5457    0.7506 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4537   -0.7837    0.8937 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3786   -0.1345    0.0606 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8829    0.7309   -0.8831 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4600    0.9738   -1.0319 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7928   -0.4151    0.2458 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7188    0.1504   -0.4914 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2863    0.0697    1.5447 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6417    0.3056    0.4058 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5657   -1.1926    0.3294 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5980   -1.0680    1.4173 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8005   -1.4835    1.6621 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5421    1.2525   -1.5443 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8157    1.6765   -1.8027 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1144   -1.1084    1.0091 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4672    0.8431   -1.2607 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7859   -0.0602   -0.3530 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