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
    4.8383    0.7669   -1.0219 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7169    1.2749   -0.6345 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4995    0.5043   -0.5071 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4365   -0.8379   -0.7893 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2342   -1.5338   -0.6491 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0787   -0.9173   -0.2293 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1209    0.4417    0.0617 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3103    1.1083   -0.0818 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1610    0.7735    0.4493 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7308    1.9567    0.8512 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0749    2.0479    1.2007 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8822    0.9370    1.1520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3154   -0.2520    0.7496 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9737   -0.3452    0.4003 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1710   -1.3413   -0.0172 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6268   -2.7121   -0.2096 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9193   -0.2661   -1.2708 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7165    1.3869   -1.0995 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6724    2.3283   -0.3900 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3246   -1.3852   -1.1283 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2459   -2.5849   -0.8851 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3348    2.1636    0.1462 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0765    2.8232    0.8831 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4402    3.0195    1.5056 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9417    1.0104    1.4278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9413   -1.1316    0.7078 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2880   -3.1190   -1.1647 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6992   -2.8122   -0.0606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1260   -3.3046    0.6035 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