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
   -1.9294    1.7310   -1.4738 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9019    0.6065   -0.8007 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6699    0.1229   -0.2241 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5132    0.8220   -0.3609 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7034    0.3683    0.1881 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9743    1.1352    0.0318 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6472   -0.8213    0.8808 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4786   -1.5406    1.0329 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6951   -1.0811    0.4843 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9932   -1.7851    0.5969 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8843    2.0710   -1.9001 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1077    2.3910   -1.6716 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8389    0.0362   -0.6831 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5887    1.7537   -0.8959 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1443    1.6548    0.9881 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9768    1.7746   -0.8506 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8457    0.4282   -0.0952 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5602   -1.2112    1.3268 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4427   -2.4837    1.5841 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8368   -2.6802    1.2434 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2659   -2.1885   -0.4106 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7520   -1.1037    1.0093 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