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
    4.6943   -1.5505    0.3276 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4395   -1.8910    0.5617 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3429   -0.9432    0.2047 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5931    0.2558   -0.4123 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5897    1.1403   -0.7424 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2672    0.8319   -0.4497 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0242   -0.3754    0.1721 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0341   -1.2542    0.4982 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3601   -0.4107    0.3403 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1860   -1.3659    0.9062 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5522   -1.1715    0.9602 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0549   -0.0099    0.4382 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2784    0.9695   -0.1343 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9067    0.7506   -0.1759 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9015    1.4942   -0.6517 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0032    2.7988   -1.2906 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5564   -1.3166    0.1667 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1462   -2.7397    0.8451 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1678   -2.8319    0.9979 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6165    0.4802   -0.6333 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7668    2.0901   -1.2264 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8266   -2.1979    0.9826 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6905   -2.2592    1.2973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1740   -1.9350    1.4033 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1451    0.1201    0.4904 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7551    1.8573   -0.5258 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4806    2.6806   -2.2934 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0136    3.2746   -1.3766 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5906    3.5086   -0.6802 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