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
   -1.5573    1.7909    1.8691 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7155    0.9067    0.9129 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6074    0.2584    0.2477 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7133    0.5097    0.5554 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7741   -0.1280   -0.0997 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1797    0.1747    0.2656 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4391   -1.0319   -1.0807 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1138   -1.3082   -1.4154 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9061   -0.6630   -0.7510 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3288   -0.9164   -1.0637 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5685    2.0572    2.1848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3947    2.2680    2.3580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7557    0.6917    0.6509 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9864    1.2173    1.3237 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3424    0.1086    1.3735 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4939    1.1760   -0.0792 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8252   -0.6005   -0.1791 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2397   -1.5382   -1.6021 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1307   -2.0278   -2.1957 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8372    0.0074   -1.3949 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4634   -1.7495   -1.7812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8422   -1.2029   -0.0988 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