Monomers

9-Methyl-3-vinyl-9H-carbazole

Identifiers

IUPAC name
3-ethenyl-9-methylcarbazole
InchI
InChI=1S/C15H13N/c1-3-11-8-9-15-13(10-11)12-6-4-5-7-14(12)16(15)2/h3-10H,1H2,2H3
InchI Key
YNTFCIUHPYUCDD-UHFFFAOYSA-N
SMILES
C=Cc1ccc2c(c1)c1ccccc1n2C
Canonical SMILES
CN1C2=C(C=C(C=C2)C=C)C3=CC=CC=C31
Isomeric SMILES
CN1C2=C(C=C(C=C2)C=C)C3=CC=CC=C31
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C15H13N
Heavy Atom Count
16
Molecular Weight
207.276
Exact Molecular Weight
207.1048
Valence Electrons
78
Radical Electrons
0
tPSA
4.93
MolLogP
3.9745
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
2
Aliphatic Heterocycles
0
Aromatic Heterocycles
1
Aliphatic Rings
0
Aromatic Rings
3

MOL File


     RDKit          3D

 29 31  0  0  0  0  0  0  0  0999 V2000
    4.4510    1.0764   -0.0224 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0018   -0.1596   -0.0379 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5934   -0.4846   -0.0305 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2091   -1.8254   -0.0483 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8730   -2.1668   -0.0418 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0979   -1.1747   -0.0174 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2661    0.1512    0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6191    0.4632   -0.0068 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8608    0.9437    0.0230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1034    2.3005    0.0466 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3834    2.8238    0.0663 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4436    1.9408    0.0618 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2084    0.5682    0.0380 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9296    0.0553    0.0184 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4402   -1.1969   -0.0058 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2725   -2.3726   -0.0169 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5215    1.2703   -0.0289 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8317    1.9684   -0.0029 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7533   -0.9486   -0.0571 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9560   -2.6262   -0.0676 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5255   -3.2043   -0.0551 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8967    1.5052    0.0072 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2308    2.9458    0.0490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5482    3.9056    0.0850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4398    2.3602    0.0774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0427   -0.1275    0.0344 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4312   -2.6585   -1.0769 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7979   -3.1841    0.5650 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2678   -2.1489    0.4438 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
  7  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  1  0
  8  3  1  0
 14  9  1  0
 15  6  1  0
  1 17  1  0
  1 18  1  0
  2 19  1  0
  4 20  1  0
  5 21  1  0
  8 22  1  0
 10 23  1  0
 11 24  1  0
 12 25  1  0
 13 26  1  0
 16 27  1  0
 16 28  1  0
 16 29  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers