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
    4.9178   -0.8906   -0.1191 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7180   -1.3927    0.0497 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4909   -0.6094   -0.0014 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4954    0.7682   -0.2393 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3518    1.5191   -0.2906 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1336    0.9117   -0.1024 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1035   -0.4632    0.1368 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2634   -1.2050    0.1854 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2319   -0.7736    0.2818 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8701   -1.9719    0.5322 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2505   -1.9798    0.6280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0052   -0.8368    0.4825 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3408    0.3493    0.2324 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9462    0.3949    0.1291 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1099    1.4221   -0.1054 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4713    2.8107   -0.3202 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0952    0.1521   -0.3112 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7765   -1.5350   -0.0667 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6241   -2.4515    0.2389 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4215    1.2872   -0.3923 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3731    2.5875   -0.4764 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2342   -2.2663    0.3705 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3436   -2.8985    0.6560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7716   -2.9042    0.8231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0817   -0.8838    0.5643 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8713    1.2796    0.1082 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5817    2.8879   -0.3241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0276    3.2206   -1.2465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0956    3.4715    0.5084 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