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
    2.1540    1.0057   -0.0390 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2633   -0.3656   -0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1636   -1.1911    0.0256 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1336   -0.6569    0.0136 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2419    0.7069   -0.0248 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8867    1.5402   -0.0511 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6717    1.0132   -0.0300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3777   -0.0932    0.0030 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4681   -1.2528    0.0337 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0529    1.6314   -0.0589 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2428   -0.7973    0.0095 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2203   -2.2646    0.0559 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7558    2.6022   -0.0809 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0640    2.0367   -0.0581 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4542   -0.1822    0.0082 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6836   -1.7800    1.0093 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6446   -1.9527   -0.8156 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