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
   -2.9774    0.7850    1.6152 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8600    1.1158    1.0543 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9478    0.1336    0.5061 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1761   -1.2188    0.5285 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2522   -2.1180   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9143   -1.7037   -0.6012 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1671   -0.3289   -0.6348 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2582    0.5427   -0.0962 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3893    0.1536   -1.2401 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7333    1.4065   -1.3303 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6545    1.5175    2.0225 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2782   -0.2348    1.6990 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6066    2.1718    0.9979 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0883   -1.5956    0.9792 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4886   -3.1749    0.0279 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6264   -2.3974   -1.0239 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4029    1.6188   -0.0947 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0878   -0.5815   -1.6585 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6545    1.7326   -1.7892 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0960    2.1757   -0.9415 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