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
-2.4916 0.5048 0.3343 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6433 -0.3983 -0.0962 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2132 -0.1885 -0.0717 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6289 -1.2006 -0.5493 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9926 -1.0822 -0.5613 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5144 0.0566 -0.0922 N 0 0 0 0 0 0 0 0 0 0 0 0
1.7986 1.0750 0.3822 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3986 0.9403 0.3889 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1491 1.4440 0.7252 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5733 0.3759 0.3287 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0961 -1.3124 -0.4711 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1656 -2.0936 -0.9146 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6455 -1.8779 -0.9364 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2197 1.9975 0.7622 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1974 1.7595 0.7714 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