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
   -2.8837    1.1944   -0.1618 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6696    1.2431   -0.5792 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5281    0.4233   -0.2162 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7686    0.9602   -0.3391 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9131    0.2711   -0.0404 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2672    0.8758   -0.1844 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7502   -1.0245    0.4053 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4896   -1.5616    0.5295 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6794   -0.8632    0.2256 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0050   -1.5559    0.3693 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3558    0.5537    0.5450 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5951    1.9356   -0.5915 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4207    2.0186   -1.3388 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8890    1.9841   -0.6917 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0530    0.1207   -0.2142 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4908    1.5841    0.6510 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3447    1.4779   -1.1231 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6404   -1.5974    0.6511 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3466   -2.5888    0.8832 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4022   -1.3950    1.3649 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7617   -2.6735    0.3409 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6521   -1.3829   -0.4854 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