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
2.4999 0.4118 -0.0989 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5911 -0.4787 -0.3763 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1901 -0.2091 -0.1092 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7355 -1.2151 -0.4324 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0566 -0.9504 -0.1762 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4936 0.2029 0.3582 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6394 1.1833 0.6785 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2858 0.9556 0.4343 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5500 0.2064 -0.3005 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2316 1.3546 0.3291 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8997 -1.4327 -0.8135 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4177 -2.1572 -0.8648 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7665 -1.7566 -0.4387 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9524 2.1244 1.1098 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3852 1.7610 0.7007 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