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
   -2.1845    2.0099    0.5804 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9908    0.7424    0.2915 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6702    0.1723    0.0761 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4821    0.9273    0.1567 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7260    0.3669   -0.0516 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9759    1.2033    0.0396 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7861   -0.9744   -0.3437 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6461   -1.7408   -0.4276 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5970   -1.1906   -0.2216 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8341   -2.0272   -0.3130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3957    2.7257    0.6813 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2103    2.3638    0.7283 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8548    0.0795    0.2070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4323    1.9711    0.3842 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3723    1.4092   -0.9785 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7221    0.7173    0.7013 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6884    2.1537    0.5171 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7428   -1.4337   -0.5100 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7036   -2.7904   -0.6570 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4837   -1.7076   -1.1515 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4606   -1.8772    0.6142 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5959   -3.1004   -0.3231 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