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
   -2.7775    1.3995    0.2297 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6033    1.2147    0.7559 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5012    0.4063    0.2779 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8132    0.8049    0.6091 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9213    0.0988    0.2240 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3058    0.5400    0.5865 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6995   -1.0447   -0.5181 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4248   -1.4462   -0.8482 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7108   -0.7270   -0.4555 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0600   -1.2563   -0.8323 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5160    2.0556    0.7292 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1484    0.9915   -0.6919 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3983    1.7428    1.7120 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9542    1.7180    1.1995 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2525    1.5524    1.0141 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7678   -0.1611    1.3157 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8729    0.5414   -0.3809 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5631   -1.6277   -0.8397 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2260   -2.3431   -1.4318 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9409   -2.3973   -0.9131 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4314   -0.9065   -1.7868 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7133   -1.1560    0.0449 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