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
    4.2677    1.2942   -0.8419 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9248    0.0571   -0.5904 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5516   -0.3068   -0.3278 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2973   -1.6672   -0.0697 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0124   -2.0684    0.1859 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0099   -1.1416    0.1874 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2371    0.1924   -0.0653 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5178    0.6020   -0.3216 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9398    0.9086   -0.0068 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2316    2.2438   -0.1798 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5416    2.6385   -0.0494 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5431    1.7247    0.2471 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2242    0.4083    0.4131 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9203   -0.0247    0.2899 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3402   -1.2417    0.4009 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9864   -2.5074    0.7019 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3272    1.4945   -1.0315 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5336    2.0680   -0.8584 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7022   -0.7063   -0.5820 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1274   -2.3864   -0.0763 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8395   -3.1187    0.3817 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6820    1.6691   -0.5188 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5010    2.9984   -0.4104 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8065    3.6874   -0.1801 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5874    2.0393    0.3511 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9859   -0.3447    0.6480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5652   -2.8787    1.6586 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0861   -2.4077    0.7386 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7515   -3.2258   -0.0939 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