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
    4.3822    1.2835    0.0857 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9839    0.0811    0.4141 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5841   -0.3046    0.3800 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2207   -1.5975    0.7403 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9135   -2.0374    0.7332 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0614   -1.1254    0.3440 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2549    0.1645   -0.0205 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5862    0.5568    0.0040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8843    0.8649   -0.3622 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1700    2.1403   -0.7883 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4479    2.5760   -1.0632 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4808    1.6768   -0.8982 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2167    0.3948   -0.4725 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9247   -0.0386   -0.1966 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4100   -1.2083    0.2218 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1331   -2.4244    0.5189 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7270    2.0702   -0.2295 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4397    1.5460    0.1203 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7434   -0.6636    0.7277 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0308   -2.2719    1.0379 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6353   -3.0283    1.0094 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8019    1.5625   -0.2836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3673    2.8457   -0.9186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7026    3.5710   -1.3992 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5100    1.9819   -1.1055 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9980   -0.3571   -0.3254 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1371   -3.0973   -0.3771 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6771   -2.9894    1.3681 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1830   -2.1721    0.7351 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