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
    4.1734    1.8528    0.0909 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9500    0.5621    0.0314 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6121   -0.0157    0.0642 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5038   -1.4024   -0.0059 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2411   -1.9459    0.0252 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1182   -1.1491    0.1222 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2065    0.2282    0.1928 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4871    0.7645    0.1605 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0478    0.7949    0.2836 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5036    2.0981    0.3762 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8451    2.3610    0.4548 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7065    1.2874    0.4378 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2708   -0.0124    0.3464 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9215   -0.2929    0.2665 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2074   -1.4322    0.1704 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7672   -2.7615    0.1251 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3624    2.5452    0.1674 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1800    2.2328    0.0632 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8242   -0.0888   -0.0459 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4070   -2.0009   -0.0817 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1114   -3.0143   -0.0266 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5187    1.8423    0.2174 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8003    2.9154    0.3869 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2340    3.3783    0.5287 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7709    1.4632    0.4984 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9398   -0.8674    0.3321 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7208   -2.8420    0.6979 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9317   -2.9979   -0.9559 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0285   -3.5030    0.5422 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