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
    4.9373    0.2346    0.0464 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8188    0.8270   -0.2811 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5399    0.1908   -0.0295 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4001   -1.0457    0.5541 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1339   -1.6031    0.7687 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0017   -0.9145    0.3948 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1783    0.3102   -0.1816 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4115    0.8769   -0.4020 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1052    0.7985   -0.4660 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5183    1.9833   -1.0473 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8740    2.2510   -1.2295 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8087    1.3185   -0.8228 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3573    0.1525   -0.2489 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0218   -0.1281   -0.0614 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3104   -1.1451    0.4519 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8872   -2.3567    1.0061 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0127   -0.7187    0.5038 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8747    0.7592   -0.1659 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8623    1.8008   -0.7435 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2792   -1.6193    0.8629 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0148   -2.5682    1.2238 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4627    1.8707   -0.8735 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7780    2.6862   -1.3524 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2164    3.1718   -1.6821 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8662    1.5279   -0.9652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0836   -0.5894    0.0754 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7954   -2.6573    0.4560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1609   -3.1901    0.9596 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1411   -2.2238    2.0770 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