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
-2.3281 -1.0104 -0.0978 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5973 -0.0289 -0.5655 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2144 0.1493 -0.1909 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5531 1.1956 -0.6936 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8737 1.3739 -0.3419 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4516 0.5145 0.5153 N 0 0 0 0 0 0 0 0 0 0 0 0
1.7327 -0.4990 1.0114 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3902 -0.7162 0.6808 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0183 -1.7798 0.5932 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3902 -1.1307 -0.3981 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0554 0.6656 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0728 1.8757 -1.3804 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4891 2.1786 -0.7194 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1683 -1.2251 1.7163 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1280 -1.5631 1.1257 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