Monomers

9-Vinylanthracene

Identifiers

IUPAC name
9-ethenylanthracene
InchI
InChI=1S/C16H12/c1-2-14-15-9-5-3-7-12(15)11-13-8-4-6-10-16(13)14/h2-11H,1H2
InchI Key
OGOYZCQQQFAGRI-UHFFFAOYSA-N
SMILES
C=Cc1c2ccccc2cc2c1cccc2
Canonical SMILES
C=CC1=C2C=CC=CC2=CC3=CC=CC=C31
Isomeric SMILES
C=CC1=C2C=CC=CC2=CC3=CC=CC=C31
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C16H12
Heavy Atom Count
16
Molecular Weight
204.272
Exact Molecular Weight
204.0939
Valence Electrons
76
Radical Electrons
0
tPSA
0.0
MolLogP
4.636
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
3
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
3

MOL File


     RDKit          3D

 28 30  0  0  0  0  0  0  0  0999 V2000
    0.7664    3.1533   -0.4235 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1471    2.2848    0.3416 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0669    0.8526    0.1121 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1349    0.0564   -0.2045 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4062    0.5706   -0.2502 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4819   -0.2337   -0.5538 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3468   -1.5809   -0.8243 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0750   -2.1065   -0.7790 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9998   -1.3016   -0.4749 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2509   -1.8729   -0.4228 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3536   -1.1125   -0.1071 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1876    0.2320    0.1556 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2875    0.9897    0.4698 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5385    0.4217    0.5233 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7160   -0.9195    0.2630 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6243   -1.6973   -0.0544 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2997    2.9317   -1.3277 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7522    4.2004   -0.1360 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3508    2.7072    1.2395 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6052    1.5956   -0.0351 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4954    0.1940   -0.5872 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1950   -2.2151   -1.0644 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9226   -3.1438   -0.9808 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3937   -2.9420   -0.6311 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1895    2.0533    0.6815 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4259    1.0246    0.7751 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6847   -1.3834    0.2994 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6921   -2.7585   -0.2705 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  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
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 12  3  1  0
  9  4  1  0
 16 11  1  0
  1 17  1  0
  1 18  1  0
  2 19  1  0
  5 20  1  0
  6 21  1  0
  7 22  1  0
  8 23  1  0
 10 24  1  0
 13 25  1  0
 14 26  1  0
 15 27  1  0
 16 28  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers