Monomers

Indene

Identifiers

IUPAC name
1H-indene
InchI
InChI=1S/C9H8/c1-2-5-9-7-3-6-8(9)4-1/h1-6H,7H2
InchI Key
YBYIRNPNPLQARY-UHFFFAOYSA-N
SMILES
c1ccc2c(c1)C=CC2
Canonical SMILES
C1C=CC2=CC=CC=C21
Isomeric SMILES
C1C=CC2=CC=CC=C21
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C9H8
Heavy Atom Count
9
Molecular Weight
116.163
Exact Molecular Weight
116.0626
Valence Electrons
44
Radical Electrons
0
tPSA
0.0
MolLogP
2.2559
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
1
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
1

MOL File


     RDKit          3D

 17 18  0  0  0  0  0  0  0  0999 V2000
    2.3090   -0.4246   -0.1959 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1401    0.9410   -0.0966 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8531    1.4233    0.0306 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2513    0.5999    0.0612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0919   -0.7630   -0.0373 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2113   -1.2576   -0.1665 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4035   -1.3795    0.0219 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3558   -0.4818    0.1503 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7030    0.8417    0.1854 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2939   -0.8752   -0.2984 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0084    1.5856   -0.1207 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7515    2.4986    0.1065 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2805   -2.3379   -0.2403 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5709   -2.4610   -0.0342 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4414   -0.6930    0.2183 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0831    1.3981   -0.7080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9469    1.3855    1.1238 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  2  0
  8  9  1  0
  6  1  1  0
  9  4  1  0
  1 10  1  0
  2 11  1  0
  3 12  1  0
  6 13  1  0
  7 14  1  0
  8 15  1  0
  9 16  1  0
  9 17  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers