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
    4.9637    0.4103    0.2526 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8241    1.0388    0.2590 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5435    0.3406    0.1148 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4816   -1.0313   -0.0363 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2425   -1.6427   -0.1689 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0622   -0.9118   -0.1538 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1156    0.4453   -0.0047 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3469    1.0457    0.1263 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1935    0.8934   -0.0269 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7016    2.1775    0.0840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0843    2.3256    0.0255 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9178    1.2386   -0.1365 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3886   -0.0305   -0.2447 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0069   -0.2085   -0.1895 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2347   -1.2846   -0.2638 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6955   -2.6587   -0.4367 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1108   -0.6517    0.1462 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9006    0.9762    0.3640 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8065    2.1046    0.3728 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3568   -1.6433   -0.0551 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1550   -2.7326   -0.2911 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3607    2.1223    0.2430 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0531    3.0190    0.2096 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5538    3.2957    0.1047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9911    1.3622   -0.1810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0465   -0.8997   -0.3738 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8734   -3.3812   -0.2185 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5116   -2.8794    0.2792 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0182   -2.8399   -1.4986 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