Monomers

1,4-Divinylbenzene

Identifiers

IUPAC name
1,4-bis(ethenyl)benzene
InchI
InChI=1S/C10H10/c1-3-9-5-7-10(4-2)8-6-9/h3-8H,1-2H2
InchI Key
WEERVPDNCOGWJF-UHFFFAOYSA-N
SMILES
C=Cc1ccc(cc1)C=C
Canonical SMILES
C=CC1=CC=C(C=C1)C=C
Isomeric SMILES
C=CC1=CC=C(C=C1)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H10
Heavy Atom Count
10
Molecular Weight
130.19
Exact Molecular Weight
130.0783
Valence Electrons
50
Radical Electrons
0
tPSA
0.0
MolLogP
2.9726
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

 20 20  0  0  0  0  0  0  0  0999 V2000
    3.7273    0.2661    0.3143 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8134   -0.5292   -0.1480 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4110   -0.2485   -0.0497 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9013    0.8846    0.5406 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4475    1.1430    0.6290 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3644    0.2662    0.1231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8764   -0.8744   -0.4720 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4675   -1.1435   -0.5663 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8073    0.5190    0.2050 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7368   -0.2817   -0.2602 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7794    0.0169    0.2197 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4945    1.1900    0.8028 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1252   -1.4612   -0.6379 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5795    1.6427    0.9737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8189    2.0439    1.0996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5958   -1.6020   -0.8902 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8235   -2.0556   -1.0435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1463    1.4444    0.6898 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5430   -1.2325   -0.7641 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7862    0.0118   -0.1417 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  2  0
  6  7  1  0
  7  8  2  0
  6  9  1  0
  9 10  2  3
  8  3  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  4 14  1  0
  5 15  1  0
  7 16  1  0
  8 17  1  0
  9 18  1  0
 10 19  1  0
 10 20  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers