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
    4.3368    1.6547   -0.3624 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9978    0.3775   -0.3591 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6252   -0.0920   -0.2556 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4233   -1.4767   -0.2656 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1423   -1.9630   -0.1699 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0450   -1.1207   -0.0637 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2381    0.2335   -0.0535 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5379    0.7146   -0.1508 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0061    0.8157    0.0598 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4110    2.1288    0.1183 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7495    2.4464    0.2342 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6682    1.4235    0.2899 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3051    0.0882    0.2344 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9462   -0.1891    0.1176 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2874   -1.3647    0.0409 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9042   -2.6563    0.0667 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3721    1.9629   -0.4414 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5929    2.4327   -0.2864 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8170   -0.3541   -0.4404 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2637   -2.1611   -0.3478 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9544   -3.0471   -0.1753 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6913    1.7908   -0.1427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6520    2.9258    0.0714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0738    3.4781    0.2807 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7233    1.6562    0.3809 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0537   -0.6939    0.2808 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8393   -3.0897    1.0859 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9908   -2.5755   -0.2220 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4270   -3.3458   -0.6678 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