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
    2.8677   -1.4299   -1.3737 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6943   -1.4905   -0.7958 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9122   -0.3168   -0.4404 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3591    0.9530   -0.6909 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5590    2.0436   -0.3245 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6570    1.8575    0.2774 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1399    0.5679    0.5461 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3203   -0.4700    0.1688 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4321    0.3902    1.1852 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9047   -0.8000    1.4463 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3586   -0.5080   -1.6373 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3971   -2.3561   -1.6111 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2830   -2.4869   -0.5695 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3158    1.1233   -1.1650 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9304    3.0550   -0.5316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2652    2.7229    0.5550 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6409   -1.4882    0.3511 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0002    1.2602    1.4430 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8939   -0.8839    1.9343 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4230   -1.7432    1.2327 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