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
    3.3372   -0.6706    0.7463 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1038   -1.0336    0.5785 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0366   -0.1173    0.2161 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2902    1.2209    0.0280 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2531    2.0946   -0.3214 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0215    1.6034   -0.4750 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3288    0.2476   -0.2939 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2668   -0.5499    0.0468 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6923   -0.2258   -0.4673 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0050   -1.4756   -0.3058 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6394    0.3515    0.6225 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1110   -1.3920    1.0192 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8562   -2.0837    0.7175 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2675    1.6786    0.1314 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4688    3.1514   -0.4671 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8240    2.2856   -0.7464 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4255   -1.6102    0.2038 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4381    0.5386   -0.7427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3057   -2.2280   -0.0413 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0560   -1.7855   -0.4492 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