Monomers
4-Vinylpyridine
Identifiers
IUPAC name
4-ethenylpyridine
InchI
InChI=1S/C7H7N/c1-2-7-3-5-8-6-4-7/h2-6H,1H2
InchI Key
KFDVPJUYSDEJTH-UHFFFAOYSA-N
SMILES
C=Cc1ccncc1
Canonical SMILES
C=CC1=CC=NC=C1
Isomeric SMILES
C=CC1=CC=NC=C1
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C7H7N
Heavy Atom Count
8
Molecular Weight
105.14
Exact Molecular Weight
105.0578
Valence Electrons
40
Radical Electrons
0
tPSA
12.89
MolLogP
1.7246
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
1
Aliphatic Rings
0
Aromatic Rings
1
MOL File
RDKit 3D
15 15 0 0 0 0 0 0 0 0999 V2000
-2.3136 0.7520 0.8518 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7051 -0.0818 0.0525 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2575 -0.1291 -0.0052 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5158 0.6884 0.7664 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9093 0.5861 0.6568 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4829 -0.2917 -0.1841 N 0 0 0 0 0 0 0 0 0 0 0 0
1.7528 -1.1142 -0.9608 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3893 -1.0073 -0.8471 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7828 1.4164 1.4799 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3904 0.7549 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2811 -0.7694 -0.5973 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1436 1.4166 1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5125 1.2469 1.2806 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2384 -1.8117 -1.6292 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2141 -1.6560 -1.4594 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
8 3 1 0
1 9 1 0
1 10 1 0
2 11 1 0
4 12 1 0
5 13 1 0
7 14 1 0
8 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers