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
   -1.9882    2.3114    0.2276 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9205    1.0301    0.0486 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6699    0.2893    0.0154 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5763    0.8523    0.1684 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7515    0.0923    0.1281 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0573    0.7814    0.3027 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6904   -1.2706   -0.0705 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4424   -1.8363   -0.2241 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7165   -1.0956   -0.1856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0563   -1.7559   -0.3581 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9227    2.8516    0.2506 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0951    2.8891    0.3619 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8589    0.4917   -0.0827 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6535    1.9182    0.3255 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0786    1.3976    1.2348 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8719    0.0615    0.3349 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2462    1.4579   -0.5618 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5996   -1.8708   -0.1035 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4229   -2.9152   -0.3796 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6348   -1.6373    0.5847 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6085   -1.2237   -1.1578 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9190   -2.8189   -0.5491 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