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
    4.9642   -0.1582    0.0401 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8455   -0.8002    0.2103 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5134   -0.1788    0.0280 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3987    1.1344   -0.3377 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1373    1.6828   -0.4992 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0148    0.9514   -0.3043 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1389   -0.3756    0.0655 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3737   -0.9422    0.2319 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1205   -0.9177    0.2070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5794   -2.1781    0.5539 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9304   -2.4520    0.6202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7988   -1.4280    0.3294 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3507   -0.1612   -0.0194 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9982    0.1021   -0.0828 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3289    1.2271   -0.3905 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8594    2.5288   -0.7560 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8896   -0.7169    0.2021 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9941    0.8643   -0.2438 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8181   -1.8634    0.5055 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2802    1.7483   -0.5019 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0577    2.7388   -0.7932 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4808   -2.0003    0.5266 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8387   -2.9459    0.7726 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2420   -3.4411    0.8927 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8527   -1.6428    0.3814 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0539    0.6195   -0.2414 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9673    2.4602   -0.9186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6111    3.2225    0.0719 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3454    2.9221   -1.6602 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