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
    4.8383   -0.6990   -0.5594 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7704   -0.1360   -1.0468 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4824   -0.2827   -0.4029 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3308   -1.0165    0.7415 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0848   -1.1456    1.3453 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0039   -0.5237    0.7746 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1680    0.2116   -0.3762 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3827    0.3502   -0.9838 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0944    0.7195   -0.7171 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5223    1.5022   -1.7432 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8562    1.8505   -1.8223 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7451    1.4056   -0.8654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2828    0.6100    0.1686 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9471    0.2538    0.2589 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2979   -0.4906    1.1550 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8204   -1.1633    2.3307 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8774   -1.2990    0.3226 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7867   -0.5649   -1.0724 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8603    0.4640   -1.9716 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1669   -1.5325    1.2351 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9639   -1.7288    2.2550 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4927    0.9296   -1.8843 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8226    1.8574   -2.5039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2282    2.4829   -2.6427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7946    1.6695   -0.9126 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9447    0.2410    0.9374 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8608   -1.5206    2.1847 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8390   -0.4374    3.1881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1534   -2.0070    2.6073 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