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
    3.6422    0.4064   -0.1661 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4626    0.9664   -0.2009 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2098    0.2136   -0.0652 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2204   -1.1514    0.1093 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0365   -1.8770    0.2392 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1782   -1.1913    0.1895 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2373    0.1732    0.0166 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0153    0.8254   -0.1052 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4903    0.9283   -0.0409 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6714    0.3990    0.0639 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5162    1.0350   -0.2740 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8446   -0.6433   -0.0380 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3537    2.0456   -0.3357 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1489   -1.7220    0.1533 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0606   -2.9462    0.3754 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1054   -1.7231    0.2866 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0358    1.8975   -0.2419 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4115    2.0088   -0.1817 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7854   -0.6587    0.2029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5648    1.0138    0.0131 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