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
    2.5075   -1.8222   -0.3587 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0956   -0.6032   -0.1009 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7382   -0.1281   -0.2177 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2676   -0.9583   -0.6263 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5805   -0.5178   -0.7444 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6756   -1.4215   -1.1891 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8864    0.7895   -0.4438 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9052    1.6358   -0.0353 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3870    1.1705    0.0723 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4239    2.1433    0.5253 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7782   -2.5428   -0.6877 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5526   -2.0982   -0.2443 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8915    0.0971    0.2347 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1124   -2.0013   -0.8822 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9360   -1.1211   -2.2200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3840   -2.4855   -1.1162 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6017   -1.2159   -0.5806 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9317    1.1339   -0.5396 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1557    2.6643    0.1993 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6172    2.0547    1.6232 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3654    2.0438   -0.0706 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0796    3.1828    0.3641 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