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
    4.3526    1.4610   -0.3912 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0013    0.3954    0.2643 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6058   -0.0307    0.3631 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3080   -1.1893    1.0866 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0245   -1.6690    1.2353 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0108   -0.9866    0.6519 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2680    0.1580   -0.0648 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5553    0.6394   -0.2142 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9345    0.6505   -0.5451 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2667    1.7557   -1.3153 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5878    1.9799   -1.6345 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6118    1.1480   -1.2204 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2498    0.0583   -0.4565 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9344   -0.1979   -0.1170 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3433   -1.1637    0.5951 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0363   -2.2538    1.2222 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3991    1.7618   -0.4530 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6474    2.0938   -0.8993 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7938   -0.1849    0.7491 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1498   -1.7257    1.5489 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7928   -2.5603    1.7915 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7264    1.5398   -0.7843 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4693    2.4209   -1.6493 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8541    2.8437   -2.2373 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6605    1.3348   -1.4795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9908   -0.6352   -0.0966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9335   -1.8530    1.7183 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3741   -2.8349    1.9026 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3671   -2.9560    0.4298 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