Monomers
9-Vinylcarbazole
Identifiers
IUPAC name
9-ethenylcarbazole
InchI
InChI=1S/C14H11N/c1-2-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)15/h2-10H,1H2
InchI Key
KKFHAJHLJHVUDM-UHFFFAOYSA-N
SMILES
C=Cn1c2ccccc2c2c1cccc2
Canonical SMILES
C=CN1C2=CC=CC=C2C3=CC=CC=C31
Isomeric SMILES
C=CN1C2=CC=CC=C2C3=CC=CC=C31
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C14H11N
Heavy Atom Count
15
Molecular Weight
193.249
Exact Molecular Weight
193.0891
Valence Electrons
72
Radical Electrons
0
tPSA
4.93
MolLogP
3.895
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
26 28 0 0 0 0 0 0 0 0999 V2000
0.0364 3.4592 0.1778 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5573 2.4083 -0.3169 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2130 1.0507 -0.1528 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9697 0.4486 0.0433 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2384 0.9585 0.0943 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3546 0.1384 0.3031 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1365 -1.2107 0.4567 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8605 -1.7347 0.4055 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7827 -0.9158 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5704 -1.1514 0.0932 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1734 0.0624 -0.1239 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5423 0.0814 -0.2655 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3143 -1.0620 -0.1971 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7082 -2.2815 0.0211 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3257 -2.3188 0.1664 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9006 3.4149 0.8021 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3307 4.4691 -0.0267 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4511 2.6279 -0.9525 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4341 2.0072 -0.0393 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3292 0.5897 0.3351 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9976 -1.8420 0.6182 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7643 -2.7968 0.5331 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0277 1.0303 -0.4367 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3997 -1.0021 -0.3151 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3302 -3.1613 0.0709 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8604 -3.2696 0.3358 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 1 0
4 5 2 0
5 6 1 0
6 7 2 0
7 8 1 0
8 9 2 0
9 10 1 0
10 11 2 0
11 12 1 0
12 13 2 0
13 14 1 0
14 15 2 0
11 3 1 0
9 4 1 0
15 10 1 0
1 16 1 0
1 17 1 0
2 18 1 0
5 19 1 0
6 20 1 0
7 21 1 0
8 22 1 0
12 23 1 0
13 24 1 0
14 25 1 0
15 26 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers