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
2.4469 0.6286 -0.1443 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6197 -0.3748 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1992 -0.1883 -0.0767 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6181 -1.3155 -0.2772 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9694 -1.1788 -0.0664 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5019 -0.0133 0.3183 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7501 1.0735 0.5163 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3874 0.9899 0.3183 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5286 0.5241 -0.3118 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1556 1.6230 0.1628 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0320 -1.3233 -0.6202 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1955 -2.2649 -0.5891 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5918 -2.0742 -0.2291 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2053 2.0328 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2376 1.8612 0.4742 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