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
    2.3275   -0.4805    0.0674 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1295    0.8673   -0.2023 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8625    1.3793   -0.2912 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2666    0.5719   -0.1155 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0874   -0.7674    0.1527 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2100   -1.2670    0.2388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4151   -1.3472    0.2848 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3560   -0.4461    0.1137 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7128    0.8507   -0.1553 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3363   -0.8662    0.1338 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9845    1.5076   -0.3412 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6541    2.4227   -0.4993 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3838   -2.3127    0.4478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6126   -2.4041    0.5002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4525   -0.6086    0.1589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0346    1.2897   -1.1266 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9508    1.6106    0.6334 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