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
   -1.7975    2.3771   -0.3391 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8367    1.0704   -0.3184 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6389    0.2905   -0.1030 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6093    0.8370    0.0929 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7501    0.0575    0.2988 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0760    0.6939    0.5057 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5554   -1.3070    0.2951 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3108   -1.8669    0.1000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8063   -1.1016   -0.1016 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1564   -1.6997   -0.3134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8837    2.9043   -0.1980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6877    2.9876   -0.4998 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8002    0.6072   -0.4691 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7638    1.9100    0.0961 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2844    0.9207    1.5688 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9059    0.0435    0.1485 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1636    1.6310   -0.1179 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4485   -1.9226    0.4564 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2036   -2.9485    0.1049 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0421   -2.7814   -0.4128 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5908   -1.3298   -1.2862 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8311   -1.3732    0.4920 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