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
   -3.6399   -0.1975   -0.2118 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5156    0.3778   -0.5229 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2339   -0.0066   -0.0102 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0929   -1.0601    0.8897 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1491   -1.4167    1.3734 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2879   -0.7323    0.9734 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1867    0.3135    0.0859 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0764    0.6304   -0.3678 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3664    1.0740   -0.3714 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5760    0.8076    0.0322 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7154   -1.0370    0.4768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5929    0.1224   -0.6216 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5565    1.2179   -1.2297 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9263   -1.6277    1.2380 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2447   -2.2504    2.0830 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2565   -1.0202    1.3588 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1587    1.4645   -1.0759 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1834    1.8807   -1.0716 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8539    0.0383    0.7154 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4037    1.4215   -0.3557 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