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
    2.5889    1.5203    0.5418 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5171    1.5429   -0.1988 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4827    0.5340   -0.1094 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8623    0.9491   -0.1870 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9110    0.0675   -0.1384 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3227    0.5154   -0.2211 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5842   -1.2667   -0.0077 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2783   -1.6891    0.0687 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7971   -0.7870    0.0182 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1805   -1.3420    0.0678 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7985    0.7725    1.2701 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3267    2.3108    0.4190 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4200    2.3856   -0.9219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0729    2.0054   -0.2890 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6434    0.6829   -1.2794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5121    1.4463    0.3421 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0060   -0.2719    0.1689 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4224   -1.9648    0.0312 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0582   -2.7445    0.1710 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9316   -0.7627   -0.4528 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1636   -2.3900   -0.3926 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4669   -1.5139    1.0993 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