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
   -2.2362    0.6805   -0.2542 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1552   -0.6976   -0.2101 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9657   -1.3633   -0.0656 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2119   -0.6183    0.0412 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1476    0.7539   -0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0712    1.4124   -0.1483 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5216    1.2665    0.1329 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3591    0.2573    0.2485 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6382   -1.0320    0.2045 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2109    1.1468   -0.3705 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0768   -1.2969   -0.2932 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8579   -2.4290   -0.0267 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1035    2.5029   -0.1799 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7247    2.3333    0.1272 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4207    0.3490    0.3597 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8884   -1.6316   -0.6956 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7651   -1.6339    1.1312 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