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
    1.7455    2.1127    1.1477 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8174    0.8905    0.6754 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6432    0.2158    0.1943 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5990    0.8159    0.2078 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7355    0.1639   -0.2574 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0568    0.8446   -0.2261 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5528   -1.1177   -0.7340 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3069   -1.7206   -0.7480 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8025   -1.0834   -0.2936 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1352   -1.7074   -0.3003 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6462    2.6432    1.5219 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8629    2.7280    1.2317 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7930    0.4257    0.6681 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7668    1.8266    0.5794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0858    1.7598   -0.8421 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3573    1.0779    0.8368 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8517    0.1780   -0.6074 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4493   -1.6284   -1.0996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2013   -2.7392   -1.1340 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4867   -1.9527    0.7437 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1126   -2.6746   -0.8392 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9180   -1.0584   -0.7251 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