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
    2.4269    1.8012   -1.3870 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0939    0.5775   -1.6391 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0040   -0.0777   -0.9465 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6703   -1.4055   -1.2450 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3568   -2.0323   -0.5966 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1079   -1.3863    0.3777 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7907   -0.0852    0.6792 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2602    0.5527    0.0142 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5218    0.6963    1.6966 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5283    0.1959    2.3837 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2469    2.2593   -1.9240 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9176    2.3897   -0.6581 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6649    0.0434   -2.3994 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2259   -1.9320   -1.9878 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5856   -3.0460   -0.8481 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9155   -1.8669    0.8930 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4564    1.5677    0.2959 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2389    1.7247    1.9054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9136   -0.8142    2.2762 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0080    0.8378    3.1098 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