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
   -2.8324    1.1939    0.6368 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6526    1.3622    0.1557 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5342    0.4790    0.0272 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7715    1.0033    0.0790 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9010    0.2360   -0.0560 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2558    0.8699    0.0109 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7216   -1.1140   -0.2512 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4758   -1.6883   -0.3120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6606   -0.8564   -0.1681 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9624   -1.5171   -0.2769 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5399    2.0447    0.6239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2197    0.3199    1.0753 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4564    2.4013   -0.2462 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8421    2.0705    0.2350 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2879    1.8163   -0.5370 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5819    0.9807    1.0823 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9721    0.1735   -0.4513 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6286   -1.7129   -0.3565 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3407   -2.7653   -0.4679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8474   -2.5478   -0.7718 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7596   -0.9687   -0.7707 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3137   -1.7809    0.7394 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