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
    4.1460   -1.7773   -0.6457 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9424   -0.4929   -0.6109 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6213    0.0563   -0.4055 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4182    1.4456   -0.3705 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1742    1.9978   -0.1769 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0793    1.1833   -0.0099 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2593   -0.1751   -0.0413 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5119   -0.7341   -0.2362 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9826   -0.7635    0.1490 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4064   -2.0803    0.2110 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7314   -2.4142    0.4148 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6431   -1.3889    0.5582 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2209   -0.0715    0.4965 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8939    0.2626    0.2924 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2273    1.4456    0.1926 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8465    2.7529    0.2916 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1716   -2.1676   -0.8051 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4211   -2.5671   -0.5358 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7662    0.1875   -0.7364 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2543    2.1016   -0.4979 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0009    3.0672   -0.1473 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6085   -1.8337   -0.2540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6788   -2.8737    0.0966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0581   -3.4441    0.4625 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6919   -1.6577    0.7195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9476    0.7192    0.6108 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0864    3.5348    0.3032 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5249    2.9383   -0.5741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4354    2.7492    1.2487 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