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
    4.3666   -1.4247   -0.2211 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9844   -0.1711   -0.2782 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6126    0.2553   -0.1973 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2963    1.6034   -0.2663 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0150    2.0893   -0.1968 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0340    1.1969   -0.0495 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2347   -0.1539    0.0235 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5513   -0.6120   -0.0507 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9395   -0.8722    0.1687 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2592   -2.2098    0.2883 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5724   -2.6121    0.4227 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5530   -1.6599    0.4351 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2251   -0.3251    0.3150 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9369    0.1003    0.1811 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3716    1.3165    0.0502 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0536    2.5970    0.0155 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4007   -1.7238   -0.2837 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6624   -2.2566   -0.1059 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7732    0.5765   -0.3944 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1121    2.2896   -0.3803 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7823    3.1417   -0.2518 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7220   -1.6722    0.0098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4526   -2.9362    0.2741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7562   -3.6728    0.5119 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5808   -1.9969    0.5418 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0532    0.3817    0.3324 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4367    3.3714   -0.4668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2495    2.8972    1.0787 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0393    2.4825   -0.5117 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