Monomers

1,3-Divinylbenzene

Identifiers

IUPAC name
1,3-bis(ethenyl)benzene
InchI
InChI=1S/C10H10/c1-3-9-6-5-7-10(4-2)8-9/h3-8H,1-2H2
InchI Key
PRJNEUBECVAVAG-UHFFFAOYSA-N
SMILES
C=Cc1cccc(c1)C=C
Canonical SMILES
C=CC1=CC(=CC=C1)C=C
Isomeric SMILES
C=CC1=CC(=CC=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
   -3.6802    0.1023    0.0686 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5388    0.6850    0.3260 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2359    0.0779    0.0421 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0903   -1.1653   -0.5234 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1606   -1.7091   -0.7782 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3163   -1.0067   -0.4663 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2085    0.2381    0.0997 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0703    0.7484    0.3394 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3551    1.0476    0.4603 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5823    0.6420    0.2683 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7208   -0.8771   -0.3758 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6054    0.6468    0.3216 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5436    1.6667    0.7717 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9988   -1.7345   -0.7763 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2546   -2.6802   -1.2198 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2958   -1.4028   -0.6523 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1768    1.7478    0.7940 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2055    2.0198    0.9029 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4417    1.2614    0.5443 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8403   -0.3082   -0.1649 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
  7  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
  6 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