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
    2.2198    1.9792    0.6254 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9512    0.6920    0.5261 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6562    0.1319    0.1771 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4363    0.9516   -0.0869 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6728    0.4391   -0.4195 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8290    1.3305   -0.6983 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7738   -0.9362   -0.4780 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6896   -1.7481   -0.2160 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5453   -1.2430    0.1161 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7166   -2.1305    0.3987 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4629    2.7304    0.4461 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2223    2.3264    0.8936 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7709    0.0125    0.7234 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3542    2.0399   -0.0400 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5738    2.1494   -1.3997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2354    1.7912    0.2287 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6471    0.7483   -1.1543 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7296   -1.3728   -0.7360 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7572   -2.8387   -0.2591 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6197   -1.8034   -0.1921 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5134   -3.1575    0.0866 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0204   -2.0923    1.4581 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