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
    4.9912   -0.6230    0.2053 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9563    0.1872    0.2120 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5682   -0.2437    0.1831 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1777   -1.5638    0.1448 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8288   -1.9329    0.1179 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1555   -0.9787    0.1291 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2407    0.3358    0.1674 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5681    0.7099    0.1941 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9182    1.0833    0.1711 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1806    2.4369    0.2018 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4553    2.9606    0.1983 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5259    2.0944    0.1626 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2856    0.7358    0.1315 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0124    0.2167    0.1350 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5139   -1.0413    0.1099 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3222   -2.2207    0.0696 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8126   -1.6802    0.1764 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0025   -0.2814    0.2270 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1937    1.2624    0.2421 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9094   -2.3425    0.1347 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5397   -2.9680    0.0881 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8675    1.7492    0.2242 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3259    3.0934    0.2294 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6387    4.0238    0.2227 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5448    2.5054    0.1596 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1593    0.0904    0.1039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2311   -2.0516    0.6772 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7093   -3.0719    0.4491 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6777   -2.4858   -0.9531 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