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
   -3.6279   -0.1107    0.6385 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4299   -0.6205    0.7763 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2051   -0.0640    0.1997 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1982    1.0768   -0.5605 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0015    1.5672   -1.0885 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2023    0.9356   -0.8711 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2135   -0.2101   -0.1105 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0093   -0.6815    0.4060 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4320   -0.9566    0.1809 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6045   -0.5962   -0.2562 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4587   -0.6048    1.1073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7494    0.7855    0.0624 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3389   -1.5393    1.3728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1299    1.5892   -0.7446 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0647    2.4668   -1.6765 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1221    1.3361   -1.2925 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0023   -1.5886    1.0109 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3744   -1.8705    0.7985 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4903   -1.1926   -0.0086 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7535    0.2782   -0.8628 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