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
2.3966 -0.7800 0.1947 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6690 0.2299 -0.2036 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2335 0.1841 -0.0951 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5131 1.2718 -0.5264 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8919 1.2655 -0.4388 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5305 0.2027 0.0668 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8497 -0.8717 0.4963 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4578 -0.8828 0.4155 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4974 -0.7722 0.1235 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9959 -1.6793 0.6139 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1777 1.0868 -0.6108 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0185 2.1175 -0.9301 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4131 2.1567 -0.7977 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3660 -1.7492 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0334 -1.7800 0.7788 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