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
    4.2731    1.6809   -0.5586 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9799    0.5562    0.0684 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6234    0.0528    0.2286 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4299   -1.1492    0.9106 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1666   -1.6705    1.0904 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0560   -1.0096    0.5957 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2462    0.1788   -0.0787 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5221    0.7228   -0.2704 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9886    0.6453   -0.4722 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4304    1.7499   -1.1598 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7744    1.9679   -1.4190 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7003    1.0515   -0.9756 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2894   -0.0796   -0.2756 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9356   -0.2692   -0.0319 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2641   -1.2466    0.6041 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8737   -2.4252    1.2316 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5125    2.3019   -0.9955 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2845    2.0301   -0.6628 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8052   -0.0092    0.4792 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2560   -1.6998    1.3129 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9767   -2.5969    1.6119 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6147    1.6407   -0.7967 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6758    2.4633   -1.5016 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0546    2.8687   -1.9720 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7512    1.1955   -1.1629 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9967   -0.8135    0.0829 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8879   -2.5895    0.8235 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8763   -2.2409    2.3249 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2478   -3.3065    0.9685 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