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
   -1.8855    2.3360   -0.0244 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8898    1.0234   -0.0479 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6588    0.2552   -0.0189 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5883    0.8403    0.0350 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7735    0.0939    0.0629 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0735    0.8093    0.1209 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6547   -1.2604    0.0345 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4135   -1.8587   -0.0194 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7548   -1.1421   -0.0472 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0938   -1.7879   -0.1054 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8569    2.8573   -0.0488 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9966    2.9591    0.0176 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8343    0.5127   -0.0898 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7043    1.9213    0.0584 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9553    1.7041   -0.5539 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2854    1.2133    1.1287 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8885    0.1444   -0.2071 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5769   -1.8478    0.0561 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3420   -2.9513   -0.0414 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6434   -1.5614    0.8523 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9457   -2.8718   -0.2338 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6964   -1.3892   -0.9285 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