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
    4.9466    0.0106    0.3274 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8683    0.6560   -0.0015 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5513    0.0837    0.1367 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3122   -1.1812    0.6227 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0000   -1.6660    0.7266 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0722   -0.8899    0.3461 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1974    0.3729   -0.1371 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4674    0.8861   -0.2551 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0512    0.9021   -0.4316 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3882    2.1330   -0.9431 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7283    2.4351   -1.1535 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6999    1.5088   -0.8514 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3712    0.2742   -0.3390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0247   -0.0277   -0.1282 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4135   -1.1285    0.3502 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0504   -2.3626    0.7972 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9022   -0.9865    0.7201 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9532    0.4155    0.2346 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9936    1.6537   -0.3891 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1366   -1.7988    0.9236 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8600   -2.6769    1.1185 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6558    1.8832   -0.6382 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6391    2.8878   -1.1921 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0141    3.3964   -1.5545 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7667    1.7365   -1.0138 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0987   -0.4709   -0.0923 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3440   -2.9002    1.4773 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9485   -2.1247    1.3927 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2342   -3.0216   -0.0533 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