Monomers

2,5-Dimethylstyrene

Identifiers

IUPAC name
2-ethenyl-1,4-dimethylbenzene
InchI
InChI=1S/C10H12/c1-4-10-7-8(2)5-6-9(10)3/h4-7H,1H2,2-3H3
InchI Key
DBWWINQJTZYDFK-UHFFFAOYSA-N
SMILES
C=Cc1cc(C)ccc1C
Canonical SMILES
CC1=CC(=C(C=C1)C)C=C
Isomeric SMILES
CC1=CC(=C(C=C1)C)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H12
Heavy Atom Count
10
Molecular Weight
132.206
Exact Molecular Weight
132.0939
Valence Electrons
52
Radical Electrons
0
tPSA
0.0
MolLogP
2.9464
H Bond Acceptors
0
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

 22 22  0  0  0  0  0  0  0  0999 V2000
   -1.5919    2.5033    0.6890 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7285    1.2358    0.4255 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6249    0.3524    0.1324 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6768    0.7938    0.1133 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7490   -0.0682   -0.1722 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1498    0.4189   -0.1900 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4453   -1.3803   -0.4338 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1463   -1.8310   -0.4171 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8737   -0.9762   -0.1378 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2572   -1.4612   -0.1210 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4588    3.1306    0.9047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6089    2.9402    0.6943 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7262    0.8210    0.4264 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9266    1.8340    0.3200 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5775    0.1864    0.8205 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6854   -0.1735   -0.9700 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2244    1.5059   -0.3999 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2651   -2.0792   -0.6609 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0616   -2.8899   -0.6315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2989   -2.4778   -0.5601 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6722   -1.5580    0.9216 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9435   -0.8268   -0.7535 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  1  0
  5  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
  9  3  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  4 14  1  0
  6 15  1  0
  6 16  1  0
  6 17  1  0
  7 18  1  0
  8 19  1  0
 10 20  1  0
 10 21  1  0
 10 22  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers