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
    4.3547   -1.6054    0.3077 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0245   -0.3738   -0.0084 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6404    0.0720   -0.0909 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4152    1.3956   -0.4342 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1331    1.8841   -0.5305 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0207    1.0954   -0.2943 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2395   -0.2207    0.0471 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5438   -0.7033    0.1413 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0057   -0.7855    0.2276 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3964   -2.0603    0.5736 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7478   -2.3567    0.6859 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7076   -1.4022    0.4586 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2837   -0.1346    0.1136 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9551    0.2162   -0.0125 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3003    1.3479   -0.3274 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9144    2.6177   -0.6467 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5841   -2.3182    0.5149 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4122   -1.8648    0.3492 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8376    0.3258   -0.2133 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2436    2.0610   -0.6306 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9291    2.9273   -0.8004 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6883   -1.7387    0.4107 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6641   -2.8377    0.7600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0808   -3.3653    0.9603 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7804   -1.6362    0.5475 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0677    0.6123   -0.0634 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1689    3.0939    0.3343 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1642    3.2781   -1.1460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8297    2.4759   -1.2336 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