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
    4.4362    1.2034    0.3538 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0065   -0.0358    0.2715 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6009   -0.3971    0.1957 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2596   -1.7517    0.1110 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9434   -2.0743    0.0407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0997   -1.1769    0.0454 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2489    0.1550    0.1292 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5867    0.5364    0.2034 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9020    0.9161    0.1223 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1494    2.2719    0.1832 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4436    2.7445    0.1554 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4866    1.8581    0.0667 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2264    0.4960    0.0061 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9417   -0.0106    0.0317 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4418   -1.2594   -0.0134 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2066   -2.5052   -0.1096 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5146    1.4339    0.4096 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7498    2.0263    0.3691 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7432   -0.8234    0.2600 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0616   -2.5050    0.1041 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6814   -3.1305   -0.0252 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8019    1.5981    0.2677 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3348    2.9793    0.2533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6445    3.8032    0.2026 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5021    2.2356    0.0453 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0732   -0.1711   -0.0632 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1089   -2.3801   -0.7493 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5370   -3.3027   -0.4378 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5362   -2.7343    0.9455 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