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
    4.4506    0.9228   -0.1664 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9754   -0.2723    0.0523 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5548   -0.5520    0.0799 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1035   -1.8579    0.3199 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7761   -2.1404    0.3497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1393   -1.1348    0.1422 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2706    0.1547   -0.0953 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6324    0.4434   -0.1257 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8526    0.9578   -0.2681 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0058    2.3011   -0.5260 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2871    2.8486   -0.6531 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3805    2.0241   -0.5161 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1853    0.6903   -0.2593 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9314    0.1141   -0.1272 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4834   -1.1429    0.1196 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2982   -2.3017    0.3251 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5404    1.0879   -0.1782 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8397    1.7839   -0.3412 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6802   -1.0963    0.2216 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8724   -2.6190    0.4783 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4471   -3.1692    0.5392 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8889    1.4707   -0.3162 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1669    2.9547   -0.6351 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4192    3.9028   -0.8557 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3557    2.4783   -0.6200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0565    0.0475   -0.1528 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0260   -2.8143    1.2662 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0672   -3.0185   -0.4991 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3770   -2.0634    0.3086 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