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
    4.9329    0.3250   -0.5668 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8577   -0.4297   -0.6434 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5229    0.0713   -0.3422 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3130    1.3745    0.0429 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0101    1.7926    0.3173 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0600    0.9306    0.2103 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1909   -0.3708   -0.1792 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4664   -0.8179   -0.4583 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0465   -1.0082   -0.2038 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3673   -2.3089   -0.5233 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6987   -2.6985   -0.4680 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6573   -1.7809   -0.0979 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3439   -0.4754    0.2238 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0107   -0.0898    0.1673 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4016    1.0805    0.4156 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0484    2.3169    0.8355 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9038   -0.1353   -0.8123 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9201    1.3586   -0.2804 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0114   -1.4745   -0.9501 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1161    2.0957    0.1437 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7880    2.8132    0.6259 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6013   -1.8553   -0.7608 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5745   -2.9717   -0.8029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9184   -3.7254   -0.7243 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6980   -2.0938   -0.0570 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0944    0.2590    0.5180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6681    2.1092    1.7299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2929    3.0774    1.0720 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7540    2.6316    0.0318 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