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
2.4583 -0.6033 0.0443 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6324 0.3935 0.2545 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2129 0.2069 0.0773 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3795 -0.9695 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7561 -1.1184 -0.4708 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5001 -0.0313 -0.2279 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.9946 1.1575 0.1534 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6303 1.2953 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2058 -1.6016 -0.2608 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5371 -0.4434 0.1841 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0364 1.3454 0.5597 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2400 -1.8353 -0.4992 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1630 -2.0730 -0.7771 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6349 2.0126 0.3397 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2644 2.2645 0.6187 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