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
   -1.8151    2.3467    0.0288 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8559    1.0566    0.1674 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6694    0.2350    0.0726 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5415    0.8303   -0.1714 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7133    0.0898   -0.2723 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0265    0.7722   -0.5407 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6323   -1.2722   -0.1204 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4149   -1.8675    0.1245 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7477   -1.1484    0.2263 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0750   -1.7414    0.4876 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9593    2.9705   -0.1645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7578    2.9269    0.1116 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7952    0.5693    0.3593 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6676    1.9096   -0.3011 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0598    1.1387   -1.5725 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1519    1.6578    0.1284 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8467    0.0792   -0.2795 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5549   -1.8477   -0.2007 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3664   -2.9452    0.2424 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5882   -1.2198    1.3172 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9703   -2.8194    0.7646 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7418   -1.7209   -0.4076 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