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
1.9453 1.1052 -1.2309 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5207 0.7665 -0.0597 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2364 0.1012 0.1564 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6301 -0.2245 -0.8366 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8600 -0.8609 -0.6347 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1702 -1.1533 0.6364 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.3324 -0.8448 1.6559 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1279 -0.2203 1.4468 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8984 1.5959 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3728 0.9148 -2.1172 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1634 0.9951 0.7964 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3795 0.0117 -1.8632 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5061 -1.0928 -1.4767 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6776 -1.1243 2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5466 0.0306 2.2450 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