Monomers

Acenaphthylene

Identifiers

IUPAC name
acenaphthylene
InchI
InChI=1S/C12H8/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-8H
InchI Key
HXGDTGSAIMULJN-UHFFFAOYSA-N
SMILES
c1cc2cccc3c2c(c1)C=C3
Canonical SMILES
C1=CC2=C3C(=C1)C=CC3=CC=C2
Isomeric SMILES
C1=CC2=C3C(=C1)C=CC3=CC=C2
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C12H8
Heavy Atom Count
12
Molecular Weight
152.196
Exact Molecular Weight
152.0626
Valence Electrons
56
Radical Electrons
0
tPSA
0.0
MolLogP
3.3236
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
1
Aromatic Carbocycles
2
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
2

MOL File


     RDKit          3D

 20 22  0  0  0  0  0  0  0  0999 V2000
    2.4033   -0.9787   -0.0610 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2506   -1.7747   -0.1037 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0073   -1.1702   -0.0666 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1884   -1.8878   -0.1047 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3449   -1.1488   -0.0601 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3372    0.2494    0.0194 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1385    0.9467    0.0564 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0007    0.1906    0.0108 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0896    1.0192    0.0555 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3272    0.4101    0.0181 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6312    2.4139    0.1358 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7106    2.3397    0.1346 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3442   -1.4941   -0.0924 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2929   -2.8481   -0.1648 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1668   -2.9515   -0.1652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3111   -1.6281   -0.0852 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2447    0.8298    0.0544 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2076    0.9976    0.0496 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2410    3.3003    0.1849 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3533    3.1847    0.1841 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
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  2  0
 10  1  1  0
  8  3  1  0
 12  7  1  0
  1 13  1  0
  2 14  1  0
  4 15  1  0
  5 16  1  0
  6 17  1  0
 10 18  1  0
 11 19  1  0
 12 20  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers