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
   -0.6932    4.3605    1.2793 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2100    3.3382    1.8960 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9697    1.9700    1.4645 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5573    0.9093    2.1736 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3693   -0.4045    1.8168 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5872   -0.7443    0.7355 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0091    0.2842    0.0367 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1919    1.6174    0.3879 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7260   -0.2614   -0.9975 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5028    0.3044   -2.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1432   -0.4946   -2.9268 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9839   -1.8521   -2.8187 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2174   -2.4394   -1.8312 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5755   -1.6390   -0.9027 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2208   -1.8832    0.1519 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6123   -3.2061    0.5760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9133    5.3737    1.6558 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0636    4.2349    0.4204 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8391    3.5027    2.7574 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1830    1.1839    3.0389 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8543   -1.1910    2.4092 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2842    2.4072   -0.1921 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6107    1.3738   -2.0620 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7524   -0.0746   -3.7154 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4927   -2.4654   -3.5529 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1018   -3.5093   -1.7593 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2732   -3.8693    0.6809 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1693   -3.1737    1.5288 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2206   -3.6523   -0.2506 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