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
2.5357 -0.4378 0.0299 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6337 0.5027 0.0594 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2000 0.2438 -0.0024 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3270 -1.0062 -0.0967 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6921 -1.2766 -0.1571 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5218 -0.2250 -0.1185 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.0525 1.0407 -0.0251 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7140 1.3062 0.0342 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5942 -0.1853 0.0794 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2873 -1.4840 -0.0429 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9836 1.5501 0.1355 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3220 -1.8689 -0.1295 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0647 -2.3014 -0.2326 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8210 1.8151 -0.0016 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3634 2.3267 0.1086 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